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

*Links on SpectraBase are not permalinks.
(3'Z,6'Z,9'Z,12'Z,15'Z,18'Z)-5-(HENICOSA-3',6',9',12',15',18'-HEXAENYL)-BENZENE-1,3-DIOL
SpectraBase Compound ID 5Ij6n3GqI4V
InChI InChI=1S/C27H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-22-26(28)24-27(29)23-25/h3-4,6-7,9-10,12-13,15-16,18-19,22-24,28-29H,2,5,8,11,14,17,20-21H2,1H3/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
InChIKey QWMMZXHJINOJSZ-KUBAVDMBSA-N
Mol Weight 392.6 g/mol
Molecular Formula C27H36O2
Exact Mass 392.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 49KRgyFiiBU
Name 5-[(3Z,6Z,9Z,12Z,15Z,18Z)-heneicosa-3,6,9,12,15,18-hexaenyl]benzene-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36O2
InChI InChI=1S/C27H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-22-26(28)24-27(29)23-25/h3-4,6-7,9-10,12-13,15-16,18-19,22-24,28-29H,2,5,8,11,14,17,20-21H2,1H3/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
InChIKey QWMMZXHJINOJSZ-KUBAVDMBSA-N
Molecular Weight 392.583 g/mol
SMILES Oc1cc(cc(c1)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)O
SPLASH splash10-0229-0900000000-9c94048aae5914c44830
Source of Spectrum B-44-1404-19
Synonyms 5-[(3Z,6Z,9Z,12Z,15Z,18Z)-heneicosa-3,6,9,12,15,18-hexaenyl]resorcinol 5-[(3Z,6Z,9Z,12Z,15Z,18Z)-henicosa-3,6,9,12,15,18-hexaenyl]benzene-1,3-diol
Wiley ID 1366085