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

*Links on SpectraBase are not permalinks.

benzenesulfinic acid isopropyl ester

View entire compound with spectra: 3 MS (GC)

benzenesulfinic acid isopropyl ester
SpectraBase Compound ID 7OhwTS3uGGi
InChI InChI=1S/C9H12O2S/c1-8(2)11-12(10)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey MGWSCKFRSMATIK-UHFFFAOYSA-N
Mol Weight 184.25 g/mol
Molecular Formula C9H12O2S
Exact Mass 184.055801 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 ABKTbFtennB
Name benzenesulfinic acid isopropyl ester
Alternate Name(s) Isopropyl benzenesulfinate benzenesulfinic acid propan-2-yl ester Benzenesulfinic acid, 1-methylethyl ester Propan-2-yl benzenesulfinate
CAS Registry Number 52736-48-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2S
InChI InChI=1S/C9H12O2S/c1-8(2)11-12(10)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKey MGWSCKFRSMATIK-UHFFFAOYSA-N
Molecular Weight 184.253 g/mol
SMILES c1cc(ccc1)S(=O)OC(C)C
SPLASH splash10-004l-9200000000-65a5b1e5d6d6540c4082
Wiley ID 1494366