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methyl 6-cyano-5-imino-3-methyl-7-(trifluoromethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-carboxylate
SpectraBase Compound ID 2LFTgjk7qh7
InChI InChI=1S/C11H7F3N4O2S/c1-4-6(9(19)20-2)21-10-17-7(11(12,13)14)5(3-15)8(16)18(4)10/h16H,1-2H3
InChIKey WNZKAXMMTLXLHU-UHFFFAOYSA-N
Mol Weight 316.26 g/mol
Molecular Formula C11H7F3N4O2S
Exact Mass 316.024181 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfGewPBlbeB
Name 6-cyano-5-imino-3-methyl-7-(trifluoromethyl)-2-thiazolo[3,2-a]pyrimidinecarboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7F3N4O2S
InChI InChI=1S/C11H7F3N4O2S/c1-4-6(9(19)20-2)21-10-17-7(11(12,13)14)5(3-15)8(16)18(4)10/h16H,1-2H3
InChIKey WNZKAXMMTLXLHU-UHFFFAOYSA-N
Molecular Weight 316.258 g/mol
SMILES N=C1N2C(=NC(=C1C#N)C(F)(F)F)SC(=C2C)C(OC)=O
SPLASH splash10-066r-9242000000-1e4ae60d31165d5e4d5a
Synonyms 6-cyano-5-imino-3-methyl-7-(trifluoromethyl)thiazolo[3,2-a]pyrimidine-2-carboxylic acid methyl ester Methyl 5-azanylidene-6-cyano-3-methyl-7-(trifluoromethyl)-[1,3]thiazolo[3,2-a]pyrimidine-2-carboxylate Methyl 6-cyano-5-imino-3-methyl-7-(trifluoromethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-carboxylate Methyl 6-cyano-5-imino-3-methyl-7-(trifluoromethyl)-[1,3]thiazolo[3,2-a]pyrimidine-2-carboxylate Methyl 6-cyano-5-imino-3-methyl-7-(trifluoromethyl)thiazolo[3,2-a]pyrimidine-2-carboxylate
Wiley ID 1511838