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4-[(4-Methyl-3-(2-chloropyrid-5-ylmethyl)triazol-5-yl)carbonyl]-2,5-diphenyl-3-hydroxypyrazole
SpectraBase Compound ID KE4ZCRU179m
InChI InChI=1S/C25H19ClN6O2/c1-16-22(28-30-31(16)15-17-12-13-20(26)27-14-17)24(33)21-23(18-8-4-2-5-9-18)29-32(25(21)34)19-10-6-3-7-11-19/h2-14,34H,15H2,1H3
InChIKey SWJLPSRPOOARAL-UHFFFAOYSA-N
Mol Weight 470.92 g/mol
Molecular Formula C25H19ClN6O2
Exact Mass 470.125802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bx3QKO9TJW
Name 4-[(4-Methyl-3-(2-chloropyrid-5-ylmethyl)triazol-5-yl)carbonyl]-2,5-diphenyl-3-hydroxypyrazole
Alternate Name(s) (1-((6-chloropyridin-3-yl)methyl)-5-methyl-1H-1,2,3-triazol-4-yl)(5-hydroxy-1,3-diphenyl-1H-pyrazol-4-yl)methanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19ClN6O2
InChI InChI=1S/C25H19ClN6O2/c1-16-22(28-30-31(16)15-17-12-13-20(26)27-14-17)24(33)21-23(18-8-4-2-5-9-18)29-32(25(21)34)19-10-6-3-7-11-19/h2-14,34H,15H2,1H3
InChIKey SWJLPSRPOOARAL-UHFFFAOYSA-N
Molecular Weight 470.920 g/mol
SMILES Oc1c(c(n[n]1-c1ccccc1)-c1ccccc1)C(c1nn[n](c1C)Cc1cnc(cc1)Cl)=O
SPLASH splash10-01tc-0901000000-fad919deae8d500394fb
Source of Spectrum J-50-1384-3h
Wiley ID 1741094