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(E)-1-[1-(4-Chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-3-phenylprop-2-en-1-one
SpectraBase Compound ID 4htrASfgpo1
InChI InChI=1S/C18H14ClN3O/c1-13-18(17(23)12-7-14-5-3-2-4-6-14)20-21-22(13)16-10-8-15(19)9-11-16/h2-12H,1H3/b12-7+
InChIKey ZSNCUYCZUVIZRO-KPKJPENVSA-N
Mol Weight 323.78 g/mol
Molecular Formula C18H14ClN3O
Exact Mass 323.08254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L7dD3eZgT0d
Name (E)-1-[1-(4-Chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl]-3-phenylprop-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14ClN3O
InChI InChI=1S/C18H14ClN3O/c1-13-18(17(23)12-7-14-5-3-2-4-6-14)20-21-22(13)16-10-8-15(19)9-11-16/h2-12H,1H3/b12-7+
InChIKey ZSNCUYCZUVIZRO-KPKJPENVSA-N
Literature Reference DOI 10.1039/c4gc00386a
Molecular Weight 323.783 g/mol
SMILES c1cc(ccc1-[n]1c(c(C(\C=C\c2ccccc2)=O)nn1)C)Cl
SPLASH splash10-0w30-2931000000-01ea7f3c87039115f3c0
Source of Spectrum GCH-16-3454/SM7-4f
Synonyms (E)-1-[1-(4-chlorophenyl)-5-methyl-4-triazolyl]-3-phenyl-2-propen-1-one (E)-1-[1-(4-chlorophenyl)-5-methyltriazol-4-yl]-3-phenylprop-2-en-1-one (E)-1-[1-(4-chlorophenyl)-5-methyl-1,2,3-triazol-4-yl]-3-phenyl-prop-2-en-1-one (E)-1-(1-(4-chlorophenyl)-5-methyl-1H-1,2,3-triazol-4-yl)-3-phenylprop-2-en-1-one
Wiley ID 1755396