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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

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 75gtRlhecL8
Name methyl 6-cyano-5-imino-3-methyl-7-(trifluoromethyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-2-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
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
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1323
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: C95986; Labnumber: AKSIN-0085; SBI_ID: SBI-001325
Temperature 315 °C