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S-benzyl-N-acetyl-cysteine

View entire compound with spectra: 1 MS (GC)

S-benzyl-N-acetyl-cysteine
SpectraBase Compound ID G0RL3Ws0nba
InChI InChI=1S/C12H15NO3S/c1-9(14)13-11(12(15)16)8-17-7-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,13,14)(H,15,16)/t11-/m0/s1
InChIKey BJUXDERNWYKSIQ-NSHDSACASA-N
Mol Weight 253.32 g/mol
Molecular Formula C12H15NO3S
Exact Mass 253.077265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KCYUGX3uh8H
Name S-benzyl-N-acetyl-cysteine
Alternate Name(s) (R)-2-acetamido-3-(benzylthio)propanoic acid (2R)-2-acetamido-3-(phenylmethylthio)propanoic acid (2R)-2-acetamido-3-benzylsulfanylpropanoic acid (2R)-2-acetamido-3-benzylsulfanyl-propanoic acid (2R)-2-acetamido-3-(phenylmethylsulfanyl)propanoic acid
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Formula C12H15NO3S
InChI InChI=1S/C12H15NO3S/c1-9(14)13-11(12(15)16)8-17-7-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,13,14)(H,15,16)/t11-/m0/s1
InChIKey BJUXDERNWYKSIQ-NSHDSACASA-N
Molecular Weight 253.316 g/mol
SMILES N([C@](C(=O)O)(CSCc1ccccc1)[H])C(=O)C
SPLASH splash10-0006-9200000000-8fcd71e0eb914c89f625
Source of Spectrum JX-2015-6-5831
Wiley ID 1729259