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(6Z,9Z,12Z,15Z)-1-(2,6-dihydroxy-4-methoxy-phenyl)octadeca-6,9,12,15-tetraen-1-one
SpectraBase Compound ID LmcLoPVgwDT
InChI InChI=1S/C25H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(26)25-23(27)19-21(29-2)20-24(25)28/h4-5,7-8,10-11,13-14,19-20,27-28H,3,6,9,12,15-18H2,1-2H3/b5-4-,8-7-,11-10-,14-13-
InChIKey ZVJQMVACQOETOP-GJDCDIHCSA-N
Mol Weight 398.5 g/mol
Molecular Formula C25H34O4
Exact Mass 398.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LqJirqtguNn
Name (6Z,9Z,12Z,15Z)-1-(2,6-dihydroxy-4-methoxy-phenyl)octadeca-6,9,12,15-tetraen-1-one
CAS Registry Number 65341-48-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O4
InChI InChI=1S/C25H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(26)25-23(27)19-21(29-2)20-24(25)28/h4-5,7-8,10-11,13-14,19-20,27-28H,3,6,9,12,15-18H2,1-2H3/b5-4-,8-7-,11-10-,14-13-
InChIKey ZVJQMVACQOETOP-GJDCDIHCSA-N
Molecular Weight 398.543 g/mol
SMILES Oc1c(c(cc(c1)OC)O)C(=O)CCCC\C=C/C\C=C/C\C=C/C\C=C/CC
SPLASH splash10-014i-0900000000-ca3f2d2db2af058cc8b3
Source of Spectrum B-30-2532-0
Synonyms (6Z,9Z,12Z,15Z)-1-(2,6-dihydroxy-4-methoxyphenyl)-1-octadeca-6,9,12,15-tetraenone (6Z,9Z,12Z,15Z)-1-[4-methoxy-2,6-bis(oxidanyl)phenyl]octadeca-6,9,12,15-tetraen-1-one
Wiley ID 1368591