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(R)-S-Ethylthio mandelate
SpectraBase Compound ID IaBlFdLN1zr
InChI InChI=1S/C10H12O2S/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3/t9-/m1/s1
InChIKey MFYJCOPKGBEPGM-SECBINFHSA-N
Mol Weight 196.26 g/mol
Molecular Formula C10H12O2S
Exact Mass 196.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBCn1Rg9tYH
Name (R)-S-Ethylthio mandelate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2S
InChI InChI=1S/C10H12O2S/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3/t9-/m1/s1
InChIKey MFYJCOPKGBEPGM-SECBINFHSA-N
Molecular Weight 196.264 g/mol
SMILES O[C@@](C(=O)SCC)(c1ccccc1)[H]
SPLASH splash10-056r-9600000000-5c6f6d8483f8a0264346
Source of Spectrum F-53-16222-15
Synonyms S-ethyl (2R)-hydroxy(phenyl)ethanethioate
Wiley ID 804656