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3-((2-Chlorobenzylidene)amino)-2-(3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-5-yl)quinazolin-4(3H)-one
SpectraBase Compound ID 95dC5m35WLt
InChI InChI=1S/C24H16Cl3N5O/c25-17-7-3-1-5-15(17)13-28-32-23(29-20-8-4-2-6-16(20)24(32)33)22-12-21(30-31-22)14-9-10-18(26)19(27)11-14/h1-11,13,22,31H,12H2
InChIKey PPFHBTGRQBBIJT-UHFFFAOYSA-N
Mol Weight 496.79 g/mol
Molecular Formula C24H16Cl3N5O
Exact Mass 495.042043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JbdnZMXurT7
Name 3-((2-Chlorobenzylidene)amino)-2-(3-(3,4-dichlorophenyl)-4,5-dihydro-1H-pyrazol-5-yl)quinazolin-4(3H)-one
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H16Cl3N5O
InChI InChI=1S/C24H16Cl3N5O/c25-17-7-3-1-5-15(17)13-28-32-23(29-20-8-4-2-6-16(20)24(32)33)22-12-21(30-31-22)14-9-10-18(26)19(27)11-14/h1-11,13,22,31H,12H2
InChIKey PPFHBTGRQBBIJT-UHFFFAOYSA-N
Instrument Name Varian MAT 311
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3158
Molecular Weight 496.785 g/mol
SMILES N1C(CC(=N1)c1cc(c(cc1)Cl)Cl)C=1N(N=Cc2c(Cl)cccc2)C(c2c(N1)cccc2)=O
SPLASH splash10-014i-0913000000-4a8487d34f689950ac5b
Source of Spectrum Y-55-1228-12
Wiley ID 1879166