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DL-Cysteine, N-acetyl-S-(5-bromo-2-hydroxyphenyl)-

View entire compound with spectra: 1 MS (GC)

DL-Cysteine, N-acetyl-S-(5-bromo-2-hydroxyphenyl)-
SpectraBase Compound ID HVSXoe3UWLN
InChI InChI=1S/C11H12BrNO4S/c1-6(14)13-8(11(16)17)5-18-10-4-7(12)2-3-9(10)15/h2-4,8,15H,5H2,1H3,(H,13,14)(H,16,17)
InChIKey LHANZSHDMSGDIX-UHFFFAOYSA-N
Mol Weight 334.18 g/mol
Molecular Formula C11H12BrNO4S
Exact Mass 332.967042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J7856scR6cQ
Name DL-Cysteine, N-acetyl-S-(5-bromo-2-hydroxyphenyl)-
Alternate Name(s) 2-Acetamido-3[(5-bromo-2-hydroxyphenyl)thio]propanoic acid (s-(5-bromo-2-hydroxyphenyl)mercapturic acid N-acetyl(5-bromo-2-hydroxyphenyl)cysteine
CAS Registry Number 126190-01-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12BrNO4S
InChI InChI=1S/C11H12BrNO4S/c1-6(14)13-8(11(16)17)5-18-10-4-7(12)2-3-9(10)15/h2-4,8,15H,5H2,1H3,(H,13,14)(H,16,17)
InChIKey LHANZSHDMSGDIX-UHFFFAOYSA-N
Molecular Weight 334.184 g/mol
SMILES OC(C(CSc1c(ccc(c1)Br)O)NC(=O)C)=O
SPLASH splash10-0006-9110000000-0d67ca66946e1a9918dc
Source of Spectrum J-55-2740-16
Wiley ID 1330026