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erythro-1,2-diphenyl-1-methylthio-2-acetoxyethane
SpectraBase Compound ID 2mRhrlUfdMM
InChI InChI=1S/C17H18O2S/c1-13(18)19-16(14-9-5-3-6-10-14)17(20-2)15-11-7-4-8-12-15/h3-12,16-17H,1-2H3
InChIKey KRQGWHCJUBLMHR-UHFFFAOYSA-N
Mol Weight 286.39 g/mol
Molecular Formula C17H18O2S
Exact Mass 286.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7F3Pp7n6oXP
Name erythro-1,2-diphenyl-1-methylthio-2-acetoxyethane
Alternate Name(s) threo-1,2-diphenyl-1-methylthio-2-acetoxyethane 2-(methylsulfanyl)-1,2-diphenylethyl acetate
CAS Registry Number 71725-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2S
InChI InChI=1S/C17H18O2S/c1-13(18)19-16(14-9-5-3-6-10-14)17(20-2)15-11-7-4-8-12-15/h3-12,16-17H,1-2H3
InChIKey KRQGWHCJUBLMHR-UHFFFAOYSA-N
Molecular Weight 286.389 g/mol
SMILES C(C(c1ccccc1)SC)(OC(=O)C)c1ccccc1
SPLASH splash10-000i-0900000000-01a5cdb09ed2a03179dd
Source of Spectrum O-25-340-2
Wiley ID 1289967