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1,5-(2'-Terphenyl)pent-1,4-dien-3-on
SpectraBase Compound ID H0qZTRsoxWx
InChI InChI=1S/C41H30O/c42-39(25-21-37-29-35(31-13-5-1-6-14-31)23-27-40(37)33-17-9-3-10-18-33)26-22-38-30-36(32-15-7-2-8-16-32)24-28-41(38)34-19-11-4-12-20-34/h1-30H/b25-21+,26-22+
InChIKey JPAPMBZSEGFADW-CDTUYSNOSA-N
Mol Weight 538.7 g/mol
Molecular Formula C41H30O
Exact Mass 538.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2klayrwoe8
Name 1,5-(2'-Terphenyl)pent-1,4-dien-3-on
Alternate Name(s) (1E,4E)-1,5-bis(2,5-diphenylphenyl)penta-1,4-dien-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C41H30O
InChI InChI=1S/C41H30O/c42-39(25-21-37-29-35(31-13-5-1-6-14-31)23-27-40(37)33-17-9-3-10-18-33)26-22-38-30-36(32-15-7-2-8-16-32)24-28-41(38)34-19-11-4-12-20-34/h1-30H/b25-21+,26-22+
InChIKey JPAPMBZSEGFADW-CDTUYSNOSA-N
Molecular Weight 538.690 g/mol
SMILES c1cc(c(cc1-c1ccccc1)\C=C\C(=O)\C=C\c1c(ccc(c1)-c1ccccc1)-c1ccccc1)-c1ccccc1
SPLASH splash10-0f89-0090000000-4f1b70466ee4c03606d1
Wiley ID 1476675