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

*Links on SpectraBase are not permalinks.

3-[(Z)-Heptadec-10-enyl]benzene-1,2-diol diacetate

View entire compound with spectra: 1 NMR

3-[(Z)-Heptadec-10-enyl]benzene-1,2-diol diacetate
SpectraBase Compound ID FeaoIqkpnwI
InChI InChI=1S/C27H42O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-25-21-19-22-26(30-23(2)28)27(25)31-24(3)29/h9-10,19,21-22H,4-8,11-18,20H2,1-3H3/b10-9-
InChIKey JDUHAPRZMCSRGU-KTKRTIGZSA-N
Mol Weight 430.6 g/mol
Molecular Formula C27H42O4
Exact Mass 430.30831 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 6rP2AZrY7BU
Name 3-[(Z)-Heptadec-10-enyl]benzene-1,2-diol diacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.308309828 u
Formula C27H42O4
InChI InChI=1S/C27H42O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-25-21-19-22-26(30-23(2)28)27(25)31-24(3)29/h9-10,19,21-22H,4-8,11-18,20H2,1-3H3/b10-9-
InChIKey JDUHAPRZMCSRGU-KTKRTIGZSA-N
Molecular Weight 430.629 g/mol
SMILES C1=C(C(=C(C=C1)CCCCCCCCC\C=C/CCCCCC)OC(=O)C)OC(=O)C