For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(6Z,9Z,12Z,15Z)-1-(2,6-dihydroxy-4-methoxy-phenyl)octadeca-6,9,12,15-tetraen-1-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KXTvD132Pdc
Name (6Z,9Z,12Z,15Z)-1-(2,6-Dihydroxy-4-methoxy-phenyl)octadeca-6,9,12,15-tetraen-1-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.245709571 u
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 C=1(C(=CC(=CC1O)OC)O)C(=O)CCCC\C=C/C\C=C/C\C=C/C\C=C/CC