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3-Phenyl-1,2,4-thiadiazole-5-carboxylic acid ethyl ester
SpectraBase Compound ID 5wKBAV8l5j0
InChI InChI=1S/C11H10N2O2S/c1-2-15-11(14)10-12-9(13-16-10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKey QAIYEEZCFZYANU-UHFFFAOYSA-N
Mol Weight 234.27 g/mol
Molecular Formula C11H10N2O2S
Exact Mass 234.046299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93iUJKflVRk
Name 3-Phenyl-1,2,4-thiadiazole-5-carboxylic acid ethyl ester
CAS Registry Number 50483-79-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N2O2S
InChI InChI=1S/C11H10N2O2S/c1-2-15-11(14)10-12-9(13-16-10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKey QAIYEEZCFZYANU-UHFFFAOYSA-N
Molecular Weight 234.273 g/mol
SMILES c1(nc(ns1)-c1ccccc1)C(=O)OCC
SPLASH splash10-000i-1930000000-a4e0b13592b15546e5ee
Source of Spectrum J-41-624-0
Synonyms Ethyl 3-Phenyl-1,2,4-thiadiazole-5-carboxylate
Wiley ID 1235599