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3-((5-Benzoyl-2-phenyl-2H-1,2,3-Triazol-4-yl)amino)-5,5-dimethylcyclohex-2-en-1-one
SpectraBase Compound ID G9YAG8GtLcU
InChI InChI=1S/C23H22N4O2/c1-23(2)14-17(13-19(28)15-23)24-22-20(21(29)16-9-5-3-6-10-16)25-27(26-22)18-11-7-4-8-12-18/h3-13H,14-15H2,1-2H3,(H,24,26)
InChIKey OXEPCIHIZAMWLK-UHFFFAOYSA-N
Mol Weight 386.46 g/mol
Molecular Formula C23H22N4O2
Exact Mass 386.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FXnXkopV2CH
Name 3-((5-Benzoyl-2-phenyl-2H-1,2,3-Triazol-4-yl)amino)-5,5-dimethylcyclohex-2-en-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22N4O2
InChI InChI=1S/C23H22N4O2/c1-23(2)14-17(13-19(28)15-23)24-22-20(21(29)16-9-5-3-6-10-16)25-27(26-22)18-11-7-4-8-12-18/h3-13H,14-15H2,1-2H3,(H,24,26)
InChIKey OXEPCIHIZAMWLK-UHFFFAOYSA-N
Literature Reference DOI 10.3987/COM-15-13353
Molecular Weight 386.455 g/mol
SMILES N(C1=CC(CC(C1)(C)C)=O)c1n[n](nc1C(c1ccccc1)=O)-c1ccccc1
SPLASH splash10-0a6r-6905000000-cfa1ba19bbd2f2638569
Source of Spectrum H1-92-642-3b
Wiley ID 1804100