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DL-N-acetyl-3-mercaptoisoleucine
SpectraBase Compound ID IbHkzfNOzzb
InChI InChI=1S/C7H13NO3S/c1-4(9)8-5(6(10)11)7(2,3)12/h5,12H,1-3H3,(H,8,9)(H,10,11)
InChIKey MNNBCKASUFBXCO-UHFFFAOYSA-N
Mol Weight 191.24 g/mol
Molecular Formula C7H13NO3S
Exact Mass 191.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 145IE8Zjl37
Name N-Acetyl-3-sulfanylvaline
CAS Registry Number 15537-71-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H13NO3S
InChI InChI=1S/C7H13NO3S/c1-4(9)8-5(6(10)11)7(2,3)12/h5,12H,1-3H3,(H,8,9)(H,10,11)
InChIKey MNNBCKASUFBXCO-UHFFFAOYSA-N
Molecular Weight 191.245 g/mol
SMILES N(C(C)=O)C(C(=O)O)C(C)(C)S
SPLASH splash10-004l-9200000000-3bf7b8bc5ec61bf04b75
Source of Spectrum HE-1982-0-0
Synonyms 2-Acetamido-3-mercapto-3-methyl-butyric acid 2-Acetamido-3-mercapto-3-methylbutanoic acid 2-Acetamido-3-methyl-3-sulfanyl-butanoic acid D-Valine, N-acetyl-3-mercapto- DL-Valine, N-acetyl-3-mercapto- N-acetyl-2-amino-3-mercapto-3-methylbutansaeure N-acetyl-3-dimethyl-DL-cysteine N-acetyl-3-mercapto-D-valine N-Acetyl-3-mercaptovaline N-Acetyl-D-penicillamine N-Acetyl-dl-penicillamine N-Acetylpenicillamine Valine, N-acetyl-3-mercapto- Valine, N-acetyl-3-mercapto-, D- Valine, N-acetyl-3-mercapto-, dl- USAF HJ-2 EINECS 239-585-4
Wiley ID 1187298