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Methanone, [7-(4-chlorophenyl)-5-(difluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](4-fluorophenyl)-
SpectraBase Compound ID 1JfBiAPtdvK
InChI InChI=1S/C19H12ClF3N4O/c20-12-5-1-10(2-6-12)16-14(17(28)11-3-7-13(21)8-4-11)15(18(22)23)26-19-24-9-25-27(16)19/h1-9,16,18H,(H,24,25,26)
InChIKey XNRLRQCAMUZTMG-UHFFFAOYSA-N
Mol Weight 404.78 g/mol
Molecular Formula C19H12ClF3N4O
Exact Mass 404.065173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Pa4LHbronF
Name Methanone, [7-(4-chlorophenyl)-5-(difluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl](4-fluorophenyl)-
Alternate Name(s) [5-[bis(fluoranyl)methyl]-7-(4-chlorophenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-(4-fluorophenyl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12ClF3N4O
InChI InChI=1S/C19H12ClF3N4O/c20-12-5-1-10(2-6-12)16-14(17(28)11-3-7-13(21)8-4-11)15(18(22)23)26-19-24-9-25-27(16)19/h1-9,16,18H,(H,24,25,26)
InChIKey XNRLRQCAMUZTMG-UHFFFAOYSA-N
Molecular Weight 404.780 g/mol
SMILES N1c2[n](C(C(=C1C(F)F)C(=O)c1ccc(cc1)F)c1ccc(cc1)Cl)ncn2
SPLASH splash10-00dm-9512000000-7b537488ecb8c5ea4084
Source of Spectrum IY-1-4569-4
Wiley ID 1653677