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N,S-Diacetyl-L-cysteine methyl ester

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

N,S-Diacetyl-L-cysteine methyl ester
SpectraBase Compound ID 678icpiSYtF
InChI InChI=1S/C8H13NO4S/c1-5(10)9-7(8(12)13-3)4-14-6(2)11/h7H,4H2,1-3H3,(H,9,10)/t7-/m0/s1
InChIKey AIDHMQPGKCFCHV-ZETCQYMHSA-N
Mol Weight 219.25 g/mol
Molecular Formula C8H13NO4S
Exact Mass 219.056529 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JRb1ut0Rkfa
Name N,S-Diacetyl-L-cysteine methyl ester
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 434035
CAS Registry Number 19547-88-7
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13NO4S
InChI 1S/C8H13NO4S/c1-5(10)9-7(8(12)13-3)4-14-6(2)11/h7H,4H2,1-3H3,(H,9,10)/t7-/m0/s1
InChIKey AIDHMQPGKCFCHV-ZETCQYMHSA-N
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms methyl (2R)-2-(acetylamino)-3-acetylthiopropanoate L-Cysteine, N-acetyl-, methyl ester, acetate
Wiley ID SIAL_1HNMR_009477