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1,7-bis(5'-Benzyl-4'-hydroxy-3'-methoxyphenyl)-1,6-heptadiene-3,5-dione
SpectraBase Compound ID 284Tw4F1npR
InChI InChI=1S/C28H26O6/c1-33-26-16-20(10-13-25(26)31)8-11-23(29)18-24(30)12-9-21-15-22(28(32)27(17-21)34-2)14-19-6-4-3-5-7-19/h3-13,15-17,31-32H,14,18H2,1-2H3/b11-8+,12-9+
InChIKey ILWFIJIATHWLDK-HZOWPXDZSA-N
Mol Weight 458.51 g/mol
Molecular Formula C28H26O6
Exact Mass 458.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AOL7MI7LYEa
Name 1,7-bis(5'-Benzyl-4'-hydroxy-3'-methoxyphenyl)-1,6-heptadiene-3,5-dione
Alternate Name(s) (1E,6E)-1-(3-benzyl-4-hydroxy-5-methoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione 5'-Benzyl-1,7-bis(4'-hydroxy-3'-methoxyphenyl)-1,6-heptadiene-3,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H26O6
InChI InChI=1S/C28H26O6/c1-33-26-16-20(10-13-25(26)31)8-11-23(29)18-24(30)12-9-21-15-22(28(32)27(17-21)34-2)14-19-6-4-3-5-7-19/h3-13,15-17,31-32H,14,18H2,1-2H3/b11-8+,12-9+
InChIKey ILWFIJIATHWLDK-HZOWPXDZSA-N
Molecular Weight 458.510 g/mol
SMILES Oc1c(cc(\C=C\C(CC(\C=C\c2cc(c(c(c2)OC)O)Cc2ccccc2)=O)=O)cc1)OC
SPLASH splash10-0ufr-2910100000-7549bbe37d3c5e956a1b
Source of Spectrum O-33-321-7
Wiley ID 763177