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2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID HLv5PbMVjYa
InChI InChI=1S/C6H2F3N3OS/c7-6(8,9)4-11-12-2-1-3(13)10-5(12)14-4/h1-2H
InChIKey NNWPSRQUPZNAGD-UHFFFAOYSA-N
Mol Weight 221.16 g/mol
Molecular Formula C6H2F3N3OS
Exact Mass 220.987067 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AGTUl3YTfpX
Name 2-(trifluoromethyl)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
CAS Registry Number 94605-13-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H2F3N3OS
InChI InChI=1S/C6H2F3N3OS/c7-6(8,9)4-11-12-2-1-3(13)10-5(12)14-4/h1-2H
InChIKey NNWPSRQUPZNAGD-UHFFFAOYSA-N
Molecular Weight 221.157 g/mol
SMILES C1=CN2C(=NC1=O)SC(C(F)(F)F)=N2
SPLASH splash10-00dl-4690000000-3bbb1cb2ec2daeecd26e
Source of Spectrum O-19-434-3
Wiley ID 1220994