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2,2-Dideuterio-2-(phenylthio)ethyl p-toluenesulfonate
SpectraBase Compound ID 8hR72oqosNB
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/i12D2
InChIKey QQBFNWOHKOMXOD-XUWBISKJSA-N
Mol Weight 310.42 g/mol
Molecular Formula C15H142D2O3S2
Exact Mass 310.06664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTGdAjeDGSV
Name 2,2-Dideuterio-2-(phenylthio)ethyl p-toluenesulfonate
CAS Registry Number 109244-24-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14D2O3S2
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/i12D2
InChIKey QQBFNWOHKOMXOD-XUWBISKJSA-N
Molecular Weight 310.422 g/mol
SMILES c1(S(=O)(=O)OCC(Sc2ccccc2)([2D])[2D])ccc(cc1)C
SPLASH splash10-0bvi-0900000000-67fa1545ad81d278214d
Source of Spectrum J-54-763-1
Wiley ID 1309521