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thio-p-toluenesulfonic acid, S-p-tolyl ester

View entire compound with spectra: 1 NMR, 2 UV-Vis, and 6 MS (GC)

thio-p-toluenesulfonic acid, S-p-tolyl ester
SpectraBase Compound ID 20CbeMLtsM4
InChI InChI=1S/C14H14O2S2/c1-11-3-7-13(8-4-11)17-18(15,16)14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChIKey HSAROCRPZOYKGS-UHFFFAOYSA-N
Mol Weight 278.38 g/mol
Molecular Formula C14H14O2S2
Exact Mass 278.043522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMcBdbKjGCE
Name TOLUENE-4-THIOSULFONIC ACID S-P-TOLYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H14O2S2
InChI InChI=1S/C14H14O2S2/c1-11-3-7-13(8-4-11)17-18(15,16)14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChIKey HSAROCRPZOYKGS-UHFFFAOYSA-N
Molecular Weight 278.0432
SMILES c1cc(S(Sc2ccc(C)cc2)(=O)=O)ccc1C
SPLASH splash10-002u-8930000000-85851c02dafaa0a4fdb1
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany