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2,3-Dimethyl-1-phenyl-4-trifluoroacetyl-5-(4-pyridyl)pyrazolo[4,3-e][1,2,4]triazine
SpectraBase Compound ID AvdiB6ht0WO
InChI InChI=1S/C19H15F3N6O/c1-12-15-17(28(26(12)2)14-6-4-3-5-7-14)25-24-16(13-8-10-23-11-9-13)27(15)18(29)19(20,21)22/h3-11H,1-2H3
InChIKey DOFXFDTZKTWRNR-UHFFFAOYSA-N
Mol Weight 400.37 g/mol
Molecular Formula C19H15F3N6O
Exact Mass 400.125944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CoAnHnCo06
Name 2,3-Dimethyl-1-phenyl-4-trifluoroacetyl-5-(4-pyridyl)pyrazolo[4,3-e][1,2,4]triazine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15F3N6O
InChI InChI=1S/C19H15F3N6O/c1-12-15-17(28(26(12)2)14-6-4-3-5-7-14)25-24-16(13-8-10-23-11-9-13)27(15)18(29)19(20,21)22/h3-11H,1-2H3
InChIKey DOFXFDTZKTWRNR-UHFFFAOYSA-N
Instrument Name GCMS-Q 1000 Ex
Ionization Type EI
Literature Reference DOI 10.1016/j.jscs.2016.11.004
Molecular Weight 400.365 g/mol
SMILES C=12N(C(=NN=C2N(N(C1C)C)c1ccccc1)c1ccncc1)C(=O)C(F)(F)F
SPLASH splash10-0002-0900000000-7eff8dec172519a9d755
Source of Spectrum SCS-21-496-7
Wiley ID 1857627