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3,3'-((1E,4E)-3-Oxopenta-1,4-diene-1,5-diyl)bis(7-chloroquinolin-2(1H)-one)
SpectraBase Compound ID AtPAxayMrk1
InChI InChI=1S/C23H14Cl2N2O3/c24-17-5-1-13-9-15(22(29)26-20(13)11-17)3-7-19(28)8-4-16-10-14-2-6-18(25)12-21(14)27-23(16)30/h1-12H,(H,26,29)(H,27,30)/b7-3+,8-4+
InChIKey QTXQLICPARUTQY-FCXRPNKRSA-N
Mol Weight 437.28 g/mol
Molecular Formula C23H14Cl2N2O3
Exact Mass 436.038148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IEZ40TlYgAT
Name 3,3'-((1E,4E)-3-Oxopenta-1,4-diene-1,5-diyl)bis(7-chloroquinolin-2(1H)-one)
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H14Cl2N2O3
InChI InChI=1S/C23H14Cl2N2O3/c24-17-5-1-13-9-15(22(29)26-20(13)11-17)3-7-19(28)8-4-16-10-14-2-6-18(25)12-21(14)27-23(16)30/h1-12H,(H,26,29)(H,27,30)/b7-3+,8-4+
InChIKey QTXQLICPARUTQY-FCXRPNKRSA-N
Instrument Name SHIMADZU GCMS 2010-DI-2010
Ionization Type EI
Literature Reference DOI 10.1002/ardp.202100094
Molecular Weight 437.282 g/mol
SMILES N1c2cc(ccc2C=C(\C=C\C(\C=C\C2=Cc3c(cc(cc3)Cl)NC2=O)=O)C1=O)Cl
SPLASH splash10-014i-9100000000-1f172b218326c976645a
Source of Spectrum APC-354-11-14b
Wiley ID 1851425