Mass2Motif: motif_21

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Mass2Motif Annotation

The following are the full annotation and the short annotation (used for network visualisation) assigned to this Mass2Motif.

Annotation: Fragments indicative for ethylphenol substructure (i.e. resulting from Tyramine – MzCloud)

Short Annotation: Fragments indicative for ethylphenol substructure (i.e. resulting from Tyramine – MzCloud)

Mass2Motif Details

The following table shows the fragment and loss features that are explained by this Mass2Motifs and their corresponding probabilities. After thresholding to save the model, the total probability left in this motif is 1.0000000000000007. The column MAGMa Substructure Annotation shows substructures and the counts of MAGMa annotations for documents linked above threshold to this motif in this experiment. Hovering over each MAGMa substructure shows a plot of the substructure.

Feature Probability MAGMA Substructure Annotation
fragment_121.0625 0.617
  • OCCc1ccccc1 (9)
  • COc1ccc(C)cc1 (7)
  • CC1=CC(=O)CCC1C (6)
  • CCc1ccc(O)cc1 (5)
  • COc1ccccc1C (3)
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  • COc1cccc(C)c1 (2)
  • CCc1ccccc1O (2)
  • C=CC1CC=C(CO)C1 (1)
  • C=CC(=O)C=CC(=C)C (1)
  • Cc1cc(C)cc(O)c1 (1)
  • Cc1cccc(C=O)c1 (1)
  • ccc1cC(C)(C)CO1 (1)
  • CC(=O)c1ccccc1 (1)
  • CCOc1ccccc1 (1)
fragment_103.0525 0.154
  • CCc1ccccc1 (26)
  • C=Cc1ccccc1 (6)
  • ccc1ccccc1 (3)
  • C=CC1CC=C(C)C1 (1)
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fragment_53.0375 0.120
fragment_91.0525 0.106
  • Cc1ccccc1 (10)
  • CC1C=CCCC1 (3)
  • CC1=CCCC1C (1)
  • cc1ccccc1 (1)
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fragment_93.0675 0.002
  • C1CCCCCC1 (2)
  • Cc1ccccc1 (2)
  • CC1C=CCCC1 (1)

Counts of Classyfire Substituent terms

Term name Count in motif Percentage in motif Percentage in experiment Absolute difference
Hydrocarbon derivative 54 81.8 78.1 3.7
Organic oxygen compound 51 77.3 69.8 7.5
Organooxygen compound 51 77.3 68.4 8.9
Organic oxide 40 60.6 62.0 1.4
Organic nitrogen compound 34 51.5 60.8 9.3
Organonitrogen compound 34 51.5 60.8 9.2
Organopnictogen compound 30 45.5 46.6 1.1
Carbonyl group 27 40.9 41.3 0.4
Ether 27 40.9 30.9 10.0
Alkyl aryl ether 25 37.9 24.7 13.1
Benzenoid 25 37.9 45.0 7.1
Monocyclic benzene moiety 24 36.4 26.6 9.7
Carboxylic acid derivative 23 34.8 35.2 0.4
Aromatic homomonocyclic compound 23 34.8 9.6 25.2
Phenoxy compound 22 33.3 11.4 22.0
Alcohol 22 33.3 18.9 14.4
Amine 21 31.8 25.0 6.8
Organoheterocyclic compound 17 25.8 38.0 12.3
Anisole 16 24.2 13.4 10.8
Phenol ether 16 24.2 13.0 11.3
Azacycle 15 22.7 46.4 23.7
Aromatic heteropolycyclic compound 14 21.2 40.3 19.1
Aralkylamine 13 19.7 10.5 9.2
Secondary alcohol 13 19.7 14.3 5.4
Monocarboxylic acid or derivatives 13 19.7 19.7 0.0
Ketone 13 19.7 11.9 7.8
Methoxybenzene 12 18.2 7.9 10.3
Carboxylic acid ester 12 18.2 13.9 4.3
Carboxamide group 12 18.2 24.1 5.9
Secondary carboxylic acid amide 11 16.7 15.3 1.4
Oxacycle 11 16.7 27.5 10.8
Secondary aliphatic amine 10 15.2 4.4 10.8
Secondary amine 10 15.2 5.3 9.9
1-hydroxy-2-unsubstituted benzenoid 10 15.2 8.9 6.3
Primary alcohol 10 15.2 5.5 9.7
Aromatic heteromonocyclic compound 8 12.1 14.3 2.1
1,2-aminoalcohol 8 12.1 3.3 8.8
Benzoyl 8 12.1 7.2 4.9
Tertiary amine 8 12.1 14.6 2.5
Tertiary aliphatic amine 8 12.1 13.7 1.6
Heteroaromatic compound 8 12.1 36.8 24.7
Phenol 8 12.1 6.8 5.3
Cyclic alcohol 8 12.1 5.3 6.9
Amino acid or derivatives 7 10.6 10.7 0.1
Pyrrolidine 7 10.6 5.8 4.8
Phenylpropane 6 9.1 1.6 7.5
Alpha-amino acid or derivatives 6 9.1 9.6 0.5
Pyrrole 6 9.1 7.6 1.5
Aryl ketone 6 9.1 4.6 4.5
Phenethylamine 6 9.1 0.5 8.6
Oxosteroid 6 9.1 3.9 5.2
3-oxosteroid 6 9.1 3.3 5.8
Cyclic ketone 6 9.1 5.2 3.9
Aliphatic homopolycyclic compound 6 9.1 3.7 5.4
Alanine or derivatives 5 7.6 1.3 6.2
Piperidine 5 7.6 9.4 1.8
Dialkyl ether 5 7.6 7.7 0.1
Benzopyran 5 7.6 10.7 3.2
1-benzopyran 5 7.6 10.7 3.1
Cyclohexenone 5 7.6 2.3 5.3
Progestogin-skeleton 5 7.6 2.5 5.0
Tertiary alcohol 5 7.6 5.5 2.0
3-oxo-delta-4-steroid 5 7.6 1.2 6.3
Alpha-hydroxy ketone 5 7.6 1.6 6.0
11-hydroxysteroid 5 7.6 1.8 5.8
20-oxosteroid 5 7.6 2.5 5.0
Delta-4-steroid 5 7.6 1.2 6.3
Indole 4 6.1 6.9 0.8
Styrene 4 6.1 1.8 4.3
Tertiary carboxylic acid amide 4 6.1 12.0 5.9
N-acyl-alpha amino acid or derivatives 4 6.1 6.4 0.3
Carboxylic acid 4 6.1 13.3 7.2
Vinylogous acid 4 6.1 5.4 0.7
1-hydroxy-4-unsubstituted benzenoid 4 6.1 5.3 0.8
Pregnane-skeleton 4 6.1 1.2 4.9
21-hydroxysteroid 4 6.1 1.1 5.0
Aromatic alcohol 4 6.1 1.9 4.2
Carbonic acid derivative 3 4.5 2.6 2.0
N-substituted-alpha-amino acid 3 4.5 1.3 3.2
Organosulfur compound 3 4.5 7.6 3.0
Hybrid peptide 3 4.5 1.0 3.5
Alpha-amino acid amide 3 4.5 4.1 0.5
Primary amine 3 4.5 6.3 1.8
Organohalogen compound 3 4.5 14.1 9.5
Acetal 3 4.5 4.4 0.1
Oxazinane 3 4.5 0.8 3.7
N-alkylpyrrolidine 3 4.5 2.2 2.3
Morpholine 3 4.5 0.8 3.7
Coumarin 3 4.5 5.6 1.0
Pyranone 3 4.5 10.1 5.5
Pyran 3 4.5 10.7 6.1
Lactone 3 4.5 12.7 8.1
17-hydroxysteroid 3 4.5 1.7 2.9
Aryl alkyl ketone 3 4.5 3.2 1.3
Alpha-acyloxy ketone 3 4.5 1.2 3.3
Dimethoxybenzene 2 3.0 1.7 1.3
O-dimethoxybenzene 2 3.0 0.9 2.1
Amphetamine or derivatives 2 3.0 2.8 0.2
3-alkylindole 2 3.0 4.9 1.9
Beta-carboline 2 3.0 2.4 0.7
Alpha-dipeptide 2 3.0 1.9 1.1
Dicarboximide 2 3.0 1.6 1.4
Pyridoindole 2 3.0 2.0 1.0
Urea 2 3.0 2.8 0.3
Hydantoin 2 3.0 0.8 2.3
Imidazolidine 2 3.0 1.1 1.9
Indole or derivatives 2 3.0 5.0 2.0
Imidazolidinone 2 3.0 1.1 1.9
Ureide 2 3.0 1.0 2.0
N-acyl urea 2 3.0 1.0 2.0
Acryloyl-group 2 3.0 0.7 2.4
Alpha,beta-unsaturated ketone 2 3.0 0.7 2.4
Enone 2 3.0 0.7 2.4
N-acyl-piperidine 2 3.0 3.4 0.4
Piperidinecarboxamide 2 3.0 2.0 1.0
Primary aliphatic amine 2 3.0 2.8 0.2
Sulfenyl compound 2 3.0 2.7 0.3
Thioether 2 3.0 3.2 0.2
Halobenzene 2 3.0 6.1 3.1
Aryl chloride 2 3.0 7.2 4.2
Benzoic acid or derivatives 2 3.0 3.3 0.2
Chlorobenzene 2 3.0 4.2 1.1
4-halobenzoic acid or derivatives 2 3.0 0.4 2.6
Halobenzoic acid or derivatives 2 3.0 0.6 2.4
Benzamide 2 3.0 1.8 1.3
Organochloride 2 3.0 8.7 5.7
Aryl halide 2 3.0 10.8 7.7
Phenoxyacetate 2 3.0 0.3 2.8
Organic 1,3-dipolar compound 2 3.0 9.9 6.9
Xylene 2 3.0 0.8 2.2
Propargyl-type 1,3-dipolar organic compound 2 3.0 9.9 6.9
Carboximidic acid derivative 2 3.0 4.9 1.9
M-xylene 2 3.0 0.7 2.3
Aromatic homopolycyclic compound 2 3.0 2.3 0.7
Methyl ester 2 3.0 2.3 0.7
Beta-hydroxy acid 2 3.0 0.8 2.3
Oxirane 2 3.0 1.2 1.9
Pyrrolidine carboxylic acid or derivatives 2 3.0 2.1 0.9
Lactam 2 3.0 10.3 7.3
Pyrrolidone 2 3.0 1.1 2.0
2-pyrrolidone 2 3.0 1.0 2.0
1,3-aminoalcohol 2 3.0 0.4 2.7
Cyclohexanol 2 3.0 0.3 2.7
Hydroxysteroid 2 3.0 2.3 0.7
Steroid ester 2 3.0 0.8 2.2
Chromone 2 3.0 3.1 0.1
Chromane 2 3.0 1.8 1.2
5-hydroxyflavonoid 2 3.0 1.6 1.4
Hydroxyflavonoid 2 3.0 1.9 1.2
7-hydroxyflavonoid 2 3.0 1.4 1.6
Flavanone 2 3.0 0.5 2.5
Dicarboxylic acid or derivatives 2 3.0 4.2 1.1
Vinylogous amide 2 3.0 4.9 1.8
Naphthoylindole 2 3.0 0.0 3.0
Benzoylindole 2 3.0 0.2 2.9
Substituted pyrrole 2 3.0 3.9 0.8
1-naphthalenecarboxylic acid or derivatives 2 3.0 0.1 3.0
Indolecarboxylic acid derivative 2 3.0 0.5 2.6
Naphthalene 2 3.0 1.9 1.1
Tyrosol derivative 2 3.0 0.2 2.9
M-methoxybenzoic acid or derivatives 1 1.5 0.5 1.0
Benzoate ester 1 1.5 1.5 0.0
P-methoxybenzoic acid or derivatives 1 1.5 0.4 1.1
Retrochalcone 1 1.5 0.1 1.4
Dialkylthioether 1 1.5 1.9 0.4
Methionine or derivatives 1 1.5 0.4 1.1
Sulfonic acid ester 1 1.5 0.1 1.4
Organosulfonic acid ester 1 1.5 0.1 1.4
Methanesulfonate 1 1.5 0.1 1.4
Organosulfonic acid or derivatives 1 1.5 3.6 2.1
Sulfonyl 1 1.5 4.0 2.4
Organic sulfonic acid or derivatives 1 1.5 3.6 2.1
Coumaran 1 1.5 1.0 0.5
Alkylarylthioether 1 1.5 0.7 0.9
Aryl thioether 1 1.5 1.3 0.2
Thiophenol ether 1 1.5 0.4 1.1
Imine 1 1.5 1.6 0.1
Cinnamylphenol 1 1.5 0.3 1.3
Cinnamic acid or derivatives 1 1.5 0.7 0.8
2'-hydroxychalcone 1 1.5 0.2 1.3
Aldehyde 1 1.5 1.1 0.4
P-hydroxybenzoic acid alkyl ester 1 1.5 0.1 1.4
Carbamic acid ester 1 1.5 1.7 0.2
Pyrrolidine carboxylic acid 1 1.5 1.4 0.1
Pyrrolidine-2-carboxamide 1 1.5 0.7 0.8
Cinnamic acid amide 1 1.5 0.1 1.4
Organic salt 1 1.5 0.7 0.8
Phenoxide 1 1.5 0.1 1.5
Tetraalkylammonium salt 1 1.5 0.3 1.2
Organic cation 1 1.5 0.6 0.9
Quaternary ammonium salt 1 1.5 0.4 1.1
1-phenylpyrrolidine 1 1.5 0.1 1.5
Pyrrolidine-3-carboxamide 1 1.5 0.0 1.5
Methoxyaniline 1 1.5 0.8 0.7
Estrane-skeleton 1 1.5 0.2 1.3
Acetylide 1 1.5 0.6 0.9
Phenanthrene 1 1.5 1.0 0.5
Tetralin 1 1.5 1.5 0.0
Ynone 1 1.5 0.4 1.1
N-acyl-amine 1 1.5 2.3 0.8
Benzodioxole 1 1.5 1.2 0.3
Hippuric acid 1 1.5 0.2 1.3
N-acyl-alpha-amino acid 1 1.5 4.4 2.9
Resorcinol 1 1.5 0.4 1.2
Butyrophenone 1 1.5 0.6 0.9
Alkyl-phenylketone 1 1.5 1.0 0.5
Alkyl halide 1 1.5 3.3 1.8
Trifluoromethylbenzene 1 1.5 0.8 0.7
Alkyl fluoride 1 1.5 2.1 0.6
N-arylpiperazine 1 1.5 1.6 0.1
Organofluoride 1 1.5 5.2 3.7
Primary aromatic amine 1 1.5 3.3 1.8
Tertiary aliphatic/aromatic amine 1 1.5 2.2 0.7
Aniline or substituted anilines 1 1.5 3.6 2.0
N-alkylpiperazine 1 1.5 3.1 1.6
Dialkylarylamine 1 1.5 3.4 1.9
Phenylpiperazine 1 1.5 0.6 0.9
Carboximidic acid 1 1.5 3.9 2.4
3-phenylpropanoic-acid 1 1.5 1.4 0.1
1,3-dicarbonyl compound 1 1.5 0.5 1.0
Bicyclic monoterpenoid 1 1.5 0.1 1.4
Alpha,beta-unsaturated carboxylic ester 1 1.5 2.9 1.3
Vinylogous ester 1 1.5 1.7 0.2
Hemiacetal 1 1.5 0.5 1.0
Enoate ester 1 1.5 2.9 1.3
Iridoid-skeleton 1 1.5 0.0 1.5
Aliphatic heteropolycyclic compound 1 1.5 3.5 2.0
3-phenylpyrrolidine 1 1.5 0.2 1.4
Phenol ester 1 1.5 0.3 1.2
Stilbene 1 1.5 0.4 1.1
N-alkylindole 1 1.5 0.7 0.8
Phenylacetamide 1 1.5 0.8 0.7
Pyridine 1 1.5 8.5 7.0
Diphenylmethane 1 1.5 2.1 0.5
Benzoxazine 1 1.5 0.3 1.3
Piperidinecarboxylic acid 1 1.5 1.2 0.3
Tropane alkaloid 1 1.5 0.2 1.3
Benzyloxycarbonyl 1 1.5 0.2 1.3
3-oxo-delta-1,4-steroid 1 1.5 1.5 0.0
17-oxosteroid 1 1.5 0.4 1.1
Delta-1,4-steroid 1 1.5 1.5 0.0
Androgen-skeleton 1 1.5 0.7 0.9

Counts of Mass2Motif Features

Two bar plots will appear below this message. The first shows the proportion of the total intensity of these features explained by this Mass2Motif. Red bars show the total intensity (across the whole dataset), blue bars show the proportion explained by the selected Mass2Motif. The second shows the number of times each feature in this Mass2Motif appears in the documents associated with this Mass2Motif.

Fragmentation Spectra Explained by Mass2Motif

The following table lists all fragmentation spectra that are explained by this Mass2Motif at the threshold specified in the experiment option.

Fragmentation spectraPrecursor MassParent massAnnotationProbabilityOverlap Score
CCMSLIB00000079696.ms 266.1387 266.1387 MLS002702945-01! M+H 0.385 0.617
CCMSLIB00000085827.ms 266.1387 266.1387 MLS001066392-01!Anisomycin from Streptomyces griseolus M+H 0.378 0.617
CCMSLIB00000579646.ms 430.2588 430.2588 2261_Mebeverine M+H 0.375 0.612
CCMSLIB00000080068.ms 447.2027 447.2027 MLS001142710-01! M+H 0.354 0.617
CCMSLIB00000085199.ms 209.0961 209.0961 MLS000069600-01!CHALCONE614-47-1 M+H 0.324 0.153
CCMSLIB00000080581.ms 451.2374 451.2374 MLS001142411-01!1-[(2S)-2-amino-4-methylsulfanylbutanoyl]-N-[(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]piperidine-4-carboxamide M+H 0.307 0.617
CCMSLIB00000084955.ms 362.1154 362.1154 MLS001148205-01!41859-67-0 M+H 0.307 0.772
CCMSLIB00000579724.ms 287.0948 287.0948 Ethofumesate M+H 0.305 0.617
CCMSLIB00000579836.ms 226.0896 226.0896 0484_Methiocarb M+H 0.233 0.725
CCMSLIB00000080027.ms 345.1333 345.1333 MLS000697642-01! M+H 0.228 0.154
CCMSLIB00000081104.ms 357.2424 357.2424 B18A05_Dictyoceratin_C M+H 0.204 0.617
CCMSLIB00000085902.ms 304.1543 304.1543 MLS001076329-01!HYOSCINE HYDROCHLORIDE M+H 0.178 0.771
CCMSLIB00000079827.ms 517.3021 517.3021 MLS001142929-01!tert-butyl (2S)-2-[4-[[(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]carbamoyl]piperidine-1-carbonyl]pyrrolidine-1-carboxylate M+H 0.178 0.617
CCMSLIB00000579861.ms 362.1154 362.1154 0009_Bezafibrate M+H 0.173 0.617
CCMSLIB00000079528.ms 252.1383 252.1383 MLS000863653-01!(E)-3-phenyl-N-(2-phenylethyl)prop-2-enamide M+H 0.164 0.154
CCMSLIB00000579590.ms 147.0441 147.0441 Cumarin M+H 0.164 0.260
CCMSLIB00000079952.ms 180.1383 180.1383 MLS001048976-01!2-(4-hydroxyphenyl)ethyl-trimethylazanium M+H 0.161 0.154
CCMSLIB00000004417.ms 363.2166 363.2166 Hydrocortisone M+H 0.152 0.613
CCMSLIB00000079874.ms 208.1332 208.1332 MLS000863632-01!3-phenyl-2-(trimethylazaniumyl)propanoate M+H 0.148 0.772
CCMSLIB00000079854.ms 426.2023 426.2023 MLS001158965-01!N-[(2S)-1-[[(1S)-2-hydroxy-1-phenylethyl]amino]-1-oxopropan-2-yl]-1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide M+H 0.141 0.771
CCMSLIB00000085803.ms 204.0489 204.0489 MLS002153464-01!4-(2-Aminoethyl)benzenesulfonyl fluoride hydrochloride30827-99-7 M+H 0.140 0.154
CCMSLIB00000004420.ms 278.2115 278.2115 Venlafaxine M+H 0.135 0.617
CCMSLIB00000085224.ms 304.1543 304.1543 MLS002153276-01!(-)-Scopolamine hydrobromide trihydrate114-49-8 M+H 0.126 0.772
CCMSLIB00000080604.ms 477.2132 477.2132 MLS001141022-01! M+H 0.124 0.617
CCMSLIB00000078447.ms 311.2006 311.2006 Mestranol [M+H] 0.112 0.724
CCMSLIB00000080432.ms 384.2533 384.2533 "MLS002473215-01!(2E,4E,12E)-13-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)trideca-2,4,12-trienamide" M+H 0.105 0.154
CCMSLIB00000085916.ms 288.1594 288.1594 MLS000069561-01!RITODRINE HYDROCHLORIDE M+H 0.101 0.260
CCMSLIB00000085949.ms 288.1594 288.1594 MLS002153782-01!Ritodrine hydrochloride23239-51-2 M+H 0.100 0.156
CCMSLIB00000080210.ms 224.0917 224.0917 MLS000776800-01!2-[(2-ethoxybenzoyl)amino]acetic acid M+H 0.100 0.771
CCMSLIB00000079405.ms 293.2111 293.2111 "MLS001048914-01!1-(2,6-dihydroxyphenyl)dodecan-1-one" M+H 0.097 0.771
CCMSLIB00000085040.ms 433.2585 433.2585 "MLS001076086-01!11BETA,17,21-TRIHYDROXYPREGN-4-ENE-3,20-DIONE 17-BUTYRATE" M+H 0.096 0.722
CCMSLIB00000085026.ms 350.1839 350.1839 "MLS000859974-01!LY-165,163" M+H 0.096 0.154
CCMSLIB00000004471.ms 415.2115 415.2115 Eplerenone M+H 0.091 0.617
CCMSLIB00000080466.ms 271.0965 271.0965 "MLS000876950-01!5,7-dihydroxy-6-methyl-2-phenyl-2,3-dihydrochromen-4-one" M+H 0.088 0.154
CCMSLIB00000078390.ms 345.1809 345.1809 Formoterol hemifumarate [M+H] 0.086 0.617
CCMSLIB00000080097.ms 261.1121 261.1121 MLS002472923-01!7-methoxy-8-(3-methyl-2-oxobutyl)chromen-2-one M+H 0.084 0.153
CCMSLIB00000579798.ms 211.0601 211.0601 Hydroxy benzyl malonic acid M+H 0.083 0.617
CCMSLIB00000079868.ms 245.1172 245.1172 MLS001048988-01! M+H 0.077 0.153
CCMSLIB00000085856.ms 447.2741 447.2741 MLS001076102-01!Westcort M+H 0.074 0.723
CCMSLIB00000579617.ms 148.0757 148.0757 Cinnamamide M+H 0.073 0.154
CCMSLIB00000080085.ms 393.2060 393.2060 MLS000697599-01! M+H 0.073 0.771
CCMSLIB00000078505.ms 288.1594 288.1594 Ritodrine hydrochloride (Yutopar) [M+H] 0.071 0.617
CCMSLIB00000078468.ms 227.0914 227.0914 Genipin [M+H] 0.070 0.878
CCMSLIB00000004963.ms 276.1594 276.1594 Rolipram M+H 0.068 0.154
CCMSLIB00000085017.ms 383.2217 383.2217 MLS000028406-01!HEXESTROL DIPROPIONATE M+H 0.068 0.612
CCMSLIB00000085894.ms 328.1696 328.1696 MLS002153392-01!JWH-015155471-08-2 M+H 0.065 0.154
CCMSLIB00000085263.ms 347.2217 347.2217 MLS001074095-01!50-22-6 M+H 0.064 0.874
CCMSLIB00000080587.ms 257.0808 257.0808 "MLS000877016-01!5,7-dihydroxy-2-phenyl-2,3-dihydrochromen-4-one" M+H 0.064 0.154
CCMSLIB00000085075.ms 285.1598 285.1598 MLS001306442-01! M+H 0.063 0.878
CCMSLIB00000084879.ms 208.1696 208.1696 MLS002153485-01!R(-)-Me5 hydriodide M+H 0.062 0.153
CCMSLIB00000085809.ms 292.2271 292.2271 MLS002154120-01!Penbutolol sulfate38363-32-5 M+H 0.061 0.878
CCMSLIB00000086193.ms 290.1751 290.1751 MLS002153877-01!5908-99-6 M+H 0.060 0.260
CCMSLIB00000579583.ms 278.2115 278.2115 0361_Venlafaxine M+H 0.059 0.617
CCMSLIB00000085361.ms 290.1751 290.1751 MLS001304011-01! M+H 0.059 0.879
CCMSLIB00000579698.ms 405.2272 405.2272 Hydrocortisonacetate M+H 0.057 0.617
CCMSLIB00000086064.ms 300.0898 300.0898 MLS001244126-01!4-(2-(6-chloroquinazolin-4-ylamino)ethyl)phenol M+H 0.056 0.154
CCMSLIB00000085490.ms 285.1121 285.1121 MLS000859889-01!Caffeic acid phenethyl ester M+H 0.056 0.154
CCMSLIB00000085041.ms 316.2060 316.2060 MLS001076126-01! M+H 0.056 0.154
CCMSLIB00000079463.ms 196.1332 196.1332 MLS000516034-01! M+H 0.055 0.771
CCMSLIB00000085207.ms 427.2016 427.2016 "MLS000860027-01!(R)-(+)-WIN 55,212-2 mesylate salt" M+H 0.055 0.154
CCMSLIB00000084926.ms 308.2220 308.2220 MLS000863279-01! M+H 0.055 0.877
CCMSLIB00000078759.ms 290.1751 290.1751 NCGC00160291-01!Tropan-3-yl-carboxylic acid (2-hydroxy-1-phenyl)-ethyl ester M+H 0.055 0.771
CCMSLIB00000086135.ms 268.1907 268.1907 MLS001146887-01!(+/-)-Metoprolol (+)-tartrate salt M+H 0.054 0.260
CCMSLIB00000084849.ms 320.1492 320.1492 MLS002154241-01!Scopolamin-N-oxide hydrobromide6106-81-6 M+H 0.054 0.770
CCMSLIB00000005322.ms 297.1849 297.1849 Exemestane M+H 0.053 0.612
CCMSLIB00000085043.ms 290.1751 290.1751 MLS001148094-01! M+H 0.052 0.879

Fragmentation Spectra Plot

The fragmentation spectra of molecules explained by this Mass2Motif are plotted below. Features (fragments and losses) explained by this Mass2Motif will be coloured red, while parent ion is coloured in blue. Click Next and Previous to cycle through the fragmentation spectra.

Result goes here: