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

*Links on SpectraBase are not permalinks.
Thiazolium, 5-hydroxy-2-(4-methoxyphenyl)-3-methyl-, hydroxide, inner salt
SpectraBase Compound ID AUxoq0pfZM3
InChI InChI=1S/C11H11NO2S/c1-12-7-10(13)15-11(12)8-3-5-9(14-2)6-4-8/h3-7H,1-2H3
InChIKey MLDUWQQTQOWRTN-UHFFFAOYSA-N
Mol Weight 221.27 g/mol
Molecular Formula C11H11NO2S
Exact Mass 221.05105 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 D0tUpvIIG36
Name Thiazolium, 5-hydroxy-2-(4-methoxyphenyl)-3-methyl-, hydroxide, inner salt
CAS Registry Number 40727-16-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2S
InChI InChI=1S/C11H11NO2S/c1-12-7-10(13)15-11(12)8-3-5-9(14-2)6-4-8/h3-7H,1-2H3
InChIKey MLDUWQQTQOWRTN-UHFFFAOYSA-N
Molecular Weight 221.274 g/mol
SMILES C[n+]1cc([O-])sc1-c1ccc(cc1)OC
SPLASH splash10-0002-2920000000-31126632929ad240308c
Source of Spectrum O-7-213-9
Synonyms 2-(4-Methoxyphenyl)-3-methyl-1,3-thiazol-3-ium-5-olate 2-(4-Methoxyphenyl)-3-methyl-5-thiazol-3-iumolate 2-(4-Methoxyphenyl)-3-methyl-thiazol-3-ium-5-olate
Wiley ID 1221115