For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
p-toluenesulfonic acid, phenyl ester
SpectraBase Compound ID 8JNhY65ZkQo
InChI InChI=1S/C13H12O3S/c1-11-7-9-13(10-8-11)17(14,15)16-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey KZQFPRKQBWRRHQ-UHFFFAOYSA-N
Mol Weight 248.3 g/mol
Molecular Formula C13H12O3S
Exact Mass 248.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 42K4dwYUPdE
Name Toluene-4-sulfonic acid phenyl ester
Alternate Name(s) 4-Methylbenzenesulfonic acid phenyl ester Phenyl p-toluenesulfonate Phenyl 4-methylbenzenesulfonate Phenyl para-toluenesulfonate
CAS Registry Number 640-60-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O3S
InChI InChI=1S/C13H12O3S/c1-11-7-9-13(10-8-11)17(14,15)16-12-5-3-2-4-6-12/h2-10H,1H3
InChIKey KZQFPRKQBWRRHQ-UHFFFAOYSA-N
Molecular Weight 248.296 g/mol
SMILES c1(ccc(cc1)C)S(=O)(=O)Oc1ccccc1
SPLASH splash10-052f-9330000000-703d4f7a5730a224e6a1
Source of Spectrum F-68-3024-1
Wiley ID 1572269