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2-(4-Butyl-1H-1,2,3-triazol-1-yl)-1-(4-cyclohexylphenyl)-ethanone
SpectraBase Compound ID 3M7SJk1Wflo
InChI InChI=1S/C20H27N3O/c1-2-3-9-19-14-23(22-21-19)15-20(24)18-12-10-17(11-13-18)16-7-5-4-6-8-16/h10-14,16H,2-9,15H2,1H3
InChIKey WMPZZMQXEIEADE-UHFFFAOYSA-N
Mol Weight 325.46 g/mol
Molecular Formula C20H27N3O
Exact Mass 325.215413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAwctHHBr2K
Name 2-(4-Butyl-1H-1,2,3-triazol-1-yl)-1-(4-cyclohexylphenyl)-ethanone
Alternate Name(s) 2-(4-butyl-1H-1,2,3-triazol-1-yl)-1-(4-cyclohexylphenyl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27N3O
InChI InChI=1S/C20H27N3O/c1-2-3-9-19-14-23(22-21-19)15-20(24)18-12-10-17(11-13-18)16-7-5-4-6-8-16/h10-14,16H,2-9,15H2,1H3
InChIKey WMPZZMQXEIEADE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo402170n
Molecular Weight 325.456 g/mol
SMILES C(c1ccc(cc1)C1CCCCC1)(C[n]1cc(nn1)CCCC)=O
SPLASH splash10-0006-9500000000-66916eed6d1c4ac7cbb5
Source of Spectrum J-79-1442-5dg
Wiley ID 1745892