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2-(Phenylthio)ethyl p-toluenesulfonate
SpectraBase Compound ID 96G3ETx9Eqa
InChI InChI=1S/C15H16O3S2/c1-13-7-9-15(10-8-13)20(16,17)18-11-12-19-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChIKey QQBFNWOHKOMXOD-UHFFFAOYSA-N
Mol Weight 308.41 g/mol
Molecular Formula C15H16O3S2
Exact Mass 308.054087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8o2nPkuJxAo
Name 2-(Phenylthio)ethyl p-toluenesulfonate
CAS Registry Number 116047-07-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O3S2
InChI InChI=1S/C15H16O3S2/c1-13-7-9-15(10-8-13)20(16,17)18-11-12-19-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChIKey QQBFNWOHKOMXOD-UHFFFAOYSA-N
Molecular Weight 308.410 g/mol
SMILES c1(S(=O)(=O)OCCSc2ccccc2)ccc(cc1)C
SPLASH splash10-074i-0900000000-c42043f5021d361ccb2f
Source of Spectrum J-54-763-0
Synonyms 2-(Phenylsulfanyl)ethyl 4-methylbenzenesulfonate
Wiley ID 1309519