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(1E,4E)-1-(2-(Benzyloxy)benzo[h]quinolin-3-yl)-5-(4-chlorophenyl)-penta-1,4-dien-3-one
SpectraBase Compound ID HFSd57dmjQX
InChI InChI=1S/C31H22ClNO2/c32-27-16-10-22(11-17-27)12-18-28(34)19-15-26-20-25-14-13-24-8-4-5-9-29(24)30(25)33-31(26)35-21-23-6-2-1-3-7-23/h1-20H,21H2/b18-12+,19-15+
InChIKey WEIHSMDTFBIFBG-XYAZGONESA-N
Mol Weight 475.98 g/mol
Molecular Formula C31H22ClNO2
Exact Mass 475.133907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J3QCLrXb6GJ
Name (1E,4E)-1-(2-(Benzyloxy)benzo[h]quinolin-3-yl)-5-(4-chlorophenyl)-penta-1,4-dien-3-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H22ClNO2
InChI InChI=1S/C31H22ClNO2/c32-27-16-10-22(11-17-27)12-18-28(34)19-15-26-20-25-14-13-24-8-4-5-9-29(24)30(25)33-31(26)35-21-23-6-2-1-3-7-23/h1-20H,21H2/b18-12+,19-15+
InChIKey WEIHSMDTFBIFBG-XYAZGONESA-N
Instrument Name SHIMADZU GCMS 2010-DI-2010
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202100094
Molecular Weight 475.975 g/mol
SMILES c1(ccc(cc1)\C=C\C(\C=C\c1cc2c(nc1OCc1ccccc1)c1c(cc2)cccc1)=O)Cl
SPLASH splash10-01ox-9106000000-e026e6d7f43450c7205f
Source of Spectrum APC-354-17-17q
Wiley ID 1851445