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1-(2-(1-benzyl-1H-1,2,3-triazol-4-yl)-3,5-dimethylphenyl)propan-1-one
SpectraBase Compound ID 4yq0SNQjE7s
InChI InChI=1S/C20H21N3O/c1-4-19(24)17-11-14(2)10-15(3)20(17)18-13-23(22-21-18)12-16-8-6-5-7-9-16/h5-11,13H,4,12H2,1-3H3
InChIKey KKZCUGXOJAYCOM-UHFFFAOYSA-N
Mol Weight 319.41 g/mol
Molecular Formula C20H21N3O
Exact Mass 319.168462 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FTPOLLVANNR
Name 1-(2-(1-benzyl-1H-1,2,3-triazol-4-yl)-3,5-dimethylphenyl)propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O
InChI InChI=1S/C20H21N3O/c1-4-19(24)17-11-14(2)10-15(3)20(17)18-13-23(22-21-18)12-16-8-6-5-7-9-16/h5-11,13H,4,12H2,1-3H3
InChIKey KKZCUGXOJAYCOM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ajoc.201800182
Molecular Weight 319.408 g/mol
SMILES c1(ccccc1)C[n]1nnc(c1)-c1c(cc(cc1C)C)C(CC)=O
SPLASH splash10-0006-4690000000-550770b76d2a61ab9124
Source of Spectrum AJO-7-SM12-2j
Wiley ID 1812351