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1,4,6-Heptatrien-3-one, 1,7-dichloro-4-(2-chloro-2-phenylethenyl)-1,7-diphenyl-, (Z,Z,Z,E)-
SpectraBase Compound ID DVa5wvlLE0O
InChI InChI=1S/C27H19Cl3O/c28-24(20-10-4-1-5-11-20)17-16-23(18-25(29)21-12-6-2-7-13-21)27(31)19-26(30)22-14-8-3-9-15-22/h1-19H/b23-16-,24-17-,25-18+,26-19-
InChIKey KZLFGPORSQIMGG-KLTMNRIISA-N
Mol Weight 465.81 g/mol
Molecular Formula C27H19Cl3O
Exact Mass 464.050148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CgpOM7Cvux8
Name 1,4,6-Heptatrien-3-one, 1,7-dichloro-4-(2-chloro-2-phenylethenyl)-1,7-diphenyl-, (Z,Z,Z,E)-
CAS Registry Number 125358-12-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H19Cl3O
InChI InChI=1S/C27H19Cl3O/c28-24(20-10-4-1-5-11-20)17-16-23(18-25(29)21-12-6-2-7-13-21)27(31)19-26(30)22-14-8-3-9-15-22/h1-19H/b23-16-,24-17-,25-18+,26-19-
InChIKey KZLFGPORSQIMGG-KLTMNRIISA-N
Molecular Weight 465.807 g/mol
SMILES C(\C=C\(c1ccccc1)Cl)(\C(\C=C/(c1ccccc1)Cl)=C/C=C/(c1ccccc1)Cl)=O
SPLASH splash10-004i-9002200000-746487b6eb1d447b19af
Source of Spectrum C-112-1613-13
Synonyms (1Z,4Z,6Z)-1,7-dichloro-4-[(E)-2-chloro-2-phenylethenyl]-1,7-diphenyl-1,4,6-heptatrien-3-one [1z,4E,6Z,1'z]-1,7-dichloro-1,7-diphenyl-4-[1-(2-chloro-2-phenyl-ethenyl)]-1,4,6-heptatrien-3-one
Wiley ID 1391527