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(1E)-1-(2-Benzyl-6,7-dimethoxyquinolin-3-yl)-4,4-dimethylpent-1-en-3-one
SpectraBase Compound ID 6IBo6C4XloC
InChI InChI=1S/C25H27NO3/c1-25(2,3)24(27)12-11-18-14-19-15-22(28-4)23(29-5)16-21(19)26-20(18)13-17-9-7-6-8-10-17/h6-12,14-16H,13H2,1-5H3/b12-11+
InChIKey FDEQICORYVWGIR-VAWYXSNFSA-N
Mol Weight 389.5 g/mol
Molecular Formula C25H27NO3
Exact Mass 389.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L5zqARIlKKP
Name (1E)-1-(2-Benzyl-6,7-dimethoxyquinolin-3-yl)-4,4-dimethylpent-1-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H27NO3
InChI InChI=1S/C25H27NO3/c1-25(2,3)24(27)12-11-18-14-19-15-22(28-4)23(29-5)16-21(19)26-20(18)13-17-9-7-6-8-10-17/h6-12,14-16H,13H2,1-5H3/b12-11+
InChIKey FDEQICORYVWGIR-VAWYXSNFSA-N
Molecular Weight 389.495 g/mol
SMILES c12nc(c(cc2cc(OC)c(c1)OC)\C=C\C(C(C)(C)C)=O)Cc1ccccc1
SPLASH splash10-0f6y-9037000000-8abaa05e3a1d15aba7c7
Source of Spectrum F4-43-2636-3f
Wiley ID 1676268