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5-(8'Z,11'Z-HEPTADECADIENYL)-1,3-BENZENEDIOL

View entire compound with spectra: 3 NMR, and 2 MS (GC)

5-(8'Z,11'Z-HEPTADECADIENYL)-1,3-BENZENEDIOL
SpectraBase Compound ID 7p3wDiWltup
InChI InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3/b7-6-,10-9-
InChIKey LQLSZSURMCEKFF-HZJYTTRNSA-N
Mol Weight 344.5 g/mol
Molecular Formula C23H36O2
Exact Mass 344.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsFvOV8JPil
Name 5-[(8Z,11Z)-heptadeca-8,11-dienyl]benzene-1,3-diol
Alternate Name(s) 5-[(8Z,11Z)-heptadeca-8,11-dienyl]resorcinol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H36O2
InChI InChI=1S/C23H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h6-7,9-10,18-20,24-25H,2-5,8,11-17H2,1H3/b7-6-,10-9-
InChIKey LQLSZSURMCEKFF-HZJYTTRNSA-N
Molecular Weight 344.539 g/mol
SMILES Oc1cc(cc(c1)CCCCCCC\C=C/C\C=C/CCCCC)O
SPLASH splash10-00di-0900000000-9959ae4f55c58b350b1f
Source of Spectrum E2-50-1487-6
Wiley ID 1556006