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1,2,4-Triazolo[2,3-a]pyrimidine, 1,8a-dihydro-5-difluoromethyl-2-trifluoromethyl-7-phenyl-
SpectraBase Compound ID LmcVkqZlmwr
InChI InChI=1S/C13H9F5N4/c14-10(15)9-6-8(7-4-2-1-3-5-7)19-12-20-11(13(16,17)18)21-22(9)12/h1-6,10,12H,(H,20,21)
InChIKey QCTCOZHTQFQFHR-UHFFFAOYSA-N
Mol Weight 316.24 g/mol
Molecular Formula C13H9F5N4
Exact Mass 316.074737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVhN1LcTipG
Name 1,2,4-Triazolo[2,3-a]pyrimidine, 1,8a-dihydro-5-difluoromethyl-2-trifluoromethyl-7-phenyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9F5N4
InChI InChI=1S/C13H9F5N4/c14-10(15)9-6-8(7-4-2-1-3-5-7)19-12-20-11(13(16,17)18)21-22(9)12/h1-6,10,12H,(H,20,21)
InChIKey QCTCOZHTQFQFHR-UHFFFAOYSA-N
Molecular Weight 316.235 g/mol
SMILES N1C(=NN2C1N=C(C=C2C(F)F)c1ccccc1)C(F)(F)F
SPLASH splash10-03di-9828000000-e8f0a5fe7dfaa94d9513
Source of Spectrum AD-0-2532-0
Synonyms 7-(difluoromethyl)-5-phenyl-2-(trifluoromethyl)-1,3a-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine 7-(Difluoromethyl)-5-phenyl-2-(trifluoromethyl)-3,3a-dihydro[1,2,4]triazolo[1,5-a]pyrimidine 7-[bis(fluoranyl)methyl]-5-phenyl-2-(trifluoromethyl)-1,3a-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
Wiley ID 1426560