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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)

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SpectraBase Spectrum ID D0tUpvIIG36
Name Thiazolium, 5-hydroxy-2-(4-methoxyphenyl)-3-methyl-, hydroxide, inner salt
Alternate Name(s) 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
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
Wiley ID 1221115