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1,7-bis(5'-Butyl-4'-hydroxy-3'-methoxyphenyl)-1,6-heptadiene-3,5-dione
SpectraBase Compound ID 2o7PaHStpmm
InChI InChI=1S/C25H28O6/c1-4-5-6-19-13-18(15-24(31-3)25(19)29)8-11-21(27)16-20(26)10-7-17-9-12-22(28)23(14-17)30-2/h7-15,28-29H,4-6,16H2,1-3H3/b10-7+,11-8+
InChIKey QYDOOWLXSUYENN-AMMQDNIMSA-N
Mol Weight 424.49 g/mol
Molecular Formula C25H28O6
Exact Mass 424.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChKqqdGs9T1
Name 1,7-bis(5'-Butyl-4'-hydroxy-3'-methoxyphenyl)-1,6-heptadiene-3,5-dione
Alternate Name(s) (1E,6E)-1-(3-butyl-4-hydroxy-5-methoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-1,6-heptadiene-3,5-dione 5'-Butyl-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 C25H28O6
InChI InChI=1S/C25H28O6/c1-4-5-6-19-13-18(15-24(31-3)25(19)29)8-11-21(27)16-20(26)10-7-17-9-12-22(28)23(14-17)30-2/h7-15,28-29H,4-6,16H2,1-3H3/b10-7+,11-8+
InChIKey QYDOOWLXSUYENN-AMMQDNIMSA-N
Molecular Weight 424.493 g/mol
SMILES Oc1c(cc(\C=C\C(CC(\C=C\c2cc(c(c(c2)CCCC)O)OC)=O)=O)cc1)OC
SPLASH splash10-004i-0920000000-0f3f12e1cebf7206bc05
Source of Spectrum O-33-321-6
Wiley ID 763178