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Methyl .alpha.-bis(4-methylphenylthio)acetate

View entire compound with spectra: 1 MS (GC)

Methyl .alpha.-bis(4-methylphenylthio)acetate
SpectraBase Compound ID 9cU8GwEe2hI
InChI InChI=1S/C17H18O2S2/c1-12-4-8-14(9-5-12)20-17(16(18)19-3)21-15-10-6-13(2)7-11-15/h4-11,17H,1-3H3
InChIKey OWJCUDPAWNVACM-UHFFFAOYSA-N
Mol Weight 318.45 g/mol
Molecular Formula C17H18O2S2
Exact Mass 318.074822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4RDHaU8xvy4
Name Methyl .alpha.-bis(4-methylphenylthio)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2S2
InChI InChI=1S/C17H18O2S2/c1-12-4-8-14(9-5-12)20-17(16(18)19-3)21-15-10-6-13(2)7-11-15/h4-11,17H,1-3H3
InChIKey OWJCUDPAWNVACM-UHFFFAOYSA-N
Molecular Weight 318.449 g/mol
SMILES C(C(=O)OC)(Sc1ccc(cc1)C)Sc1ccc(cc1)C
SPLASH splash10-01pa-1901000000-926bd7d2005e38025040
Source of Spectrum O1-29-1988-34
Synonyms Methyl bis[(4-methylphenyl)sulfanyl]acetate
Wiley ID 818573