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2,4-Pentadienal, 5-(9-anthracenyl)-3-methyl-, (E,E)-
SpectraBase Compound ID 4t2cLcqH3AT
InChI InChI=1S/C20H16O/c1-15(12-13-21)10-11-20-18-8-4-2-6-16(18)14-17-7-3-5-9-19(17)20/h2-14H,1H3/b11-10+,15-12+
InChIKey UMLAXSMUHHZXGQ-GCHFJXRNSA-N
Mol Weight 272.35 g/mol
Molecular Formula C20H16O
Exact Mass 272.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzY3THzVvZg
Name 2,4-Pentadienal, 5-(9-anthracenyl)-3-methyl-, (E,E)-
Alternate Name(s) (2E,4E)-5-(9-anthryl)-3-methyl-2,4-pentadienal 3-Methyl 5-(9-anthryl)-2e,4e-pentadienal
CAS Registry Number 116381-18-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16O
InChI InChI=1S/C20H16O/c1-15(12-13-21)10-11-20-18-8-4-2-6-16(18)14-17-7-3-5-9-19(17)20/h2-14H,1H3/b11-10+,15-12+
InChIKey UMLAXSMUHHZXGQ-GCHFJXRNSA-N
Molecular Weight 272.347 g/mol
SMILES c1(\C=C\C(=C\C=O)C)c2c(cccc2)cc2c1cccc2
SPLASH splash10-05i3-0090000000-3641003a3d27c90d2656
Source of Spectrum I-68-384-6
Wiley ID 1276771