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Ethyl 3-(3-trifluoromethylphenyl)-1,2,4-thiadiazole-5-carboxylate
SpectraBase Compound ID E618MBY2bOV
InChI InChI=1S/C12H9F3N2O2S/c1-2-19-11(18)10-16-9(17-20-10)7-4-3-5-8(6-7)12(13,14)15/h3-6H,2H2,1H3
InChIKey RDWHFLWEKAAYOJ-UHFFFAOYSA-N
Mol Weight 302.27 g/mol
Molecular Formula C12H9F3N2O2S
Exact Mass 302.033683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GF5gCmyz2kJ
Name Ethyl 3-(3-trifluoromethylphenyl)-1,2,4-thiadiazole-5-carboxylate
CAS Registry Number 50483-80-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9F3N2O2S
InChI InChI=1S/C12H9F3N2O2S/c1-2-19-11(18)10-16-9(17-20-10)7-4-3-5-8(6-7)12(13,14)15/h3-6H,2H2,1H3
InChIKey RDWHFLWEKAAYOJ-UHFFFAOYSA-N
Molecular Weight 302.271 g/mol
SMILES c1(nc(ns1)-c1cc(C(F)(F)F)ccc1)C(=O)OCC
SPLASH splash10-0udi-0095000000-87e6b564b94882f39267
Source of Spectrum J-41-624-0
Synonyms Ethyl 3-[3-(trifluoromethyl)phenyl]-1,2,4-thiadiazole-5-carboxylate
Wiley ID 1304220