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(R)-S-Ethylthio 3,4-dimethoxymandelate
SpectraBase Compound ID 5XoX6Zvz8kR
InChI InChI=1S/C12H16O4S/c1-4-17-12(14)11(13)8-5-6-9(15-2)10(7-8)16-3/h5-7,11,13H,4H2,1-3H3/t11-/m1/s1
InChIKey WJSSFYYSATVFGL-LLVKDONJSA-N
Mol Weight 256.32 g/mol
Molecular Formula C12H16O4S
Exact Mass 256.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JV7ZLIZzFaV
Name (R)-S-Ethylthio 3,4-dimethoxymandelate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4S
InChI InChI=1S/C12H16O4S/c1-4-17-12(14)11(13)8-5-6-9(15-2)10(7-8)16-3/h5-7,11,13H,4H2,1-3H3/t11-/m1/s1
InChIKey WJSSFYYSATVFGL-LLVKDONJSA-N
Molecular Weight 256.316 g/mol
SMILES O[C@@](C(=O)SCC)(c1cc(OC)c(cc1)OC)[H]
SPLASH splash10-00ri-0910000000-af1c9721404bb4c8d772
Source of Spectrum F-53-16222-15
Synonyms S-ethyl (2R)-(3,4-dimethoxyphenyl)(hydroxy)ethanethioate
Wiley ID 804655