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(2E,6E)-1-(2-hydroxy-5-methoxy-3-methyl-phenyl)-3,7,11,15-tetramethyl-hexadeca-2,6,14-triene-5,12-dione
SpectraBase Compound ID LNtF3ctNq3q
InChI InChI=1S/C28H40O4/c1-19(2)11-14-27(30)22(5)10-8-9-20(3)15-25(29)16-21(4)12-13-24-18-26(32-7)17-23(6)28(24)31/h11-12,15,17-18,22,31H,8-10,13-14,16H2,1-7H3/b20-15+,21-12+
InChIKey JPGDEUMQAOEBRT-QQBSMCONSA-N
Mol Weight 440.6 g/mol
Molecular Formula C28H40O4
Exact Mass 440.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3E5fePFMJs
Name (2E,6E)-1-(2-hydroxy-5-methoxy-3-methyl-phenyl)-3,7,11,15-tetramethyl-hexadeca-2,6,14-triene-5,12-dione
CAS Registry Number 80756-05-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H40O4
InChI InChI=1S/C28H40O4/c1-19(2)11-14-27(30)22(5)10-8-9-20(3)15-25(29)16-21(4)12-13-24-18-26(32-7)17-23(6)28(24)31/h11-12,15,17-18,22,31H,8-10,13-14,16H2,1-7H3/b20-15+,21-12+
InChIKey JPGDEUMQAOEBRT-QQBSMCONSA-N
Molecular Weight 440.624 g/mol
SMILES Oc1c(cc(cc1C)OC)C\C=C\(CC(\C=C\(CCCC(C(CC=C(C)C)=O)C)C)=O)C
SPLASH splash10-014r-4962100000-34b8532d3d0e89b76c3b
Source of Spectrum F-37-3212-0
Synonyms (2E,6E)-1-(5-methoxy-3-methyl-2-oxidanyl-phenyl)-3,7,11,15-tetramethyl-hexadeca-2,6,14-triene-5,12-dione
Wiley ID 1384846