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Famotidine breakdown - nominalmass 188

View entire compound with spectra: 2 MS (GC)

Famotidine breakdown - nominalmass 188
SpectraBase Compound ID IuB81XS9X5t
InChI InChI=1S/C8H15N7O2S3/c9-6(15-20(12,16)17)1-2-18-3-5-4-19-8(13-5)14-7(10)11/h4H,1-3H2,(H8-,9,10,11,12,13,14,15,16,17)
InChIKey VZUQZRYQNIGGIH-UHFFFAOYSA-N
Mol Weight 337.44 g/mol
Molecular Formula C8H15N7O2S3
Exact Mass 337.044936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1HYuuWwazTs
Name Famotidine breakdown - nominalmass 188
Comments Note: The molecular formula of the structure shown is C8H17N7O2S3 - which differs from the formula reported for the mass spectrum (C8H15N7O2S3)
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Formula C8H15N7O2S3
InChI InChI=1S/C8H15N7O2S3/c9-6(15-20(12,16)17)1-2-18-3-5-4-19-8(13-5)14-7(10)11/h4H,1-3H2,(H8-,9,10,11,12,13,14,15,16,17)
InChIKey VZUQZRYQNIGGIH-UHFFFAOYSA-N
Molecular Weight 337.435 g/mol
SMILES NC(=Nc1nc(CSCCC(N[S+](N)([O-])=O)=N)cs1)N
SPLASH splash10-000i-7900000000-348c30a6b8a7a9876ec2
Synonyms Guanidine, N''-[4-[[[3-[(aminosulfonyl)amino]-3-iminopropyl]thio]methyl]-2-thiazolyl]- Guanidine, N-[4-[[[3-[(aminosulfonyl)amino]-3-iminopropyl]thio]methyl]-2-thiazolyl]- N''-{4-[({3-[(aminosulfonyl)amino]-3-iminopropyl}sulfanyl)methyl]-1,3-thiazol-2-yl}guanidine
Wiley ID 1508056