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3-(4-Chlorophenyl)-2-[4-(trifluoromethyl)benzyl]-1,2,4-triazino-[2,3-b]indazole
SpectraBase Compound ID 3K7HNuEA37D
InChI InChI=1S/C23H14ClF3N4/c24-17-11-7-15(8-12-17)21-20(13-14-5-9-16(10-6-14)23(25,26)27)28-22-18-3-1-2-4-19(18)29-31(22)30-21/h1-12H,13H2
InChIKey AHXYSHKCZGKFBY-UHFFFAOYSA-N
Mol Weight 438.84 g/mol
Molecular Formula C23H14ClF3N4
Exact Mass 438.085909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KaAXaV3DGZA
Name 3-(4-Chlorophenyl)-2-[4-(trifluoromethyl)benzyl]-1,2,4-triazino-[2,3-b]indazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H14ClF3N4
InChI InChI=1S/C23H14ClF3N4/c24-17-11-7-15(8-12-17)21-20(13-14-5-9-16(10-6-14)23(25,26)27)28-22-18-3-1-2-4-19(18)29-31(22)30-21/h1-12H,13H2
InChIKey AHXYSHKCZGKFBY-UHFFFAOYSA-N
Molecular Weight 438.841 g/mol
SMILES c12[n](N=C(C(=N2)Cc2ccc(C(F)(F)F)cc2)c2ccc(cc2)Cl)nc2ccccc12
SPLASH splash10-000i-3610900000-daa667dbda3dd038ef77
Source of Spectrum U1-2011-6936-12j
Synonyms 3-(4-Chlorophenyl)-2-[[4-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazino[2,3-b]indazole
Wiley ID 1702890