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4-(2-Benzoyl-4-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-carboxaldehyde
SpectraBase Compound ID EJo9mghwR1C
InChI InChI=1S/C17H12ClN3O2/c1-11-19-20-16(10-22)21(11)15-8-7-13(18)9-14(15)17(23)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey XCXMEYSBBHIZEF-UHFFFAOYSA-N
Mol Weight 325.76 g/mol
Molecular Formula C17H12ClN3O2
Exact Mass 325.061804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4I3Xholnwe
Name 4-(2-Benzoyl-4-chlorophenyl)-5-methyl-4H-1,2,4-triazole-3-carboxaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClN3O2
InChI InChI=1S/C17H12ClN3O2/c1-11-19-20-16(10-22)21(11)15-8-7-13(18)9-14(15)17(23)12-5-3-2-4-6-12/h2-10H,1H3
InChIKey XCXMEYSBBHIZEF-UHFFFAOYSA-N
Molecular Weight 325.755 g/mol
SMILES c1(-[n]2c(nnc2C)C=O)c(C(=O)c2ccccc2)cc(cc1)Cl
SPLASH splash10-0002-0092000000-806c757a8139a3727159
Source of Spectrum Y-17-550-0
Synonyms 4-(2-benzoyl-4-chloro-phenyl)-5-methyl-1,2,4-triazole-3-carbaldehyde 4-(2-benzoyl-4-chlorophenyl)-5-methyl-1,2,4-triazole-3-carboxaldehyde 4-[4-chloranyl-2-(phenylcarbonyl)phenyl]-5-methyl-1,2,4-triazole-3-carbaldehyde
Wiley ID 1323913