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1,2,4-Triazolo[1,5-a]pyrimidine-2-carboxylic acid, 7-difluoromethyl-5-methyl-
SpectraBase Compound ID 52eg9w75Q5d
InChI InChI=1S/C8H6F2N4O2/c1-3-2-4(5(9)10)14-8(11-3)12-6(13-14)7(15)16/h2,5H,1H3,(H,15,16)
InChIKey VIQHWADMQYGCLE-UHFFFAOYSA-N
Mol Weight 228.16 g/mol
Molecular Formula C8H6F2N4O2
Exact Mass 228.045882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9KAmEgr0PNQ
Name 1,2,4-Triazolo[1,5-a]pyrimidine-2-carboxylic acid, 7-difluoromethyl-5-methyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6F2N4O2
InChI InChI=1S/C8H6F2N4O2/c1-3-2-4(5(9)10)14-8(11-3)12-6(13-14)7(15)16/h2,5H,1H3,(H,15,16)
InChIKey VIQHWADMQYGCLE-UHFFFAOYSA-N
Molecular Weight 228.159 g/mol
SMILES OC(c1nc2[n](n1)C(C(F)F)=CC(=N2)C)=O
SPLASH splash10-0f89-9510000000-fb6a3926b7f3335bc175
Source of Spectrum AD-0-2532-0
Synonyms 7-(difluoromethyl)-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid 7-[bis(fluoranyl)methyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid
Wiley ID 1433979