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

*Links on SpectraBase are not permalinks.
(3-acetoxy-2-octadeca-9,12-dienoyloxy-propyl) octadec-9-enoate
SpectraBase Compound ID Fyl9CE06tFa
InChI InChI=1S/C41H72O6/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-40(43)46-37-39(36-45-38(3)42)47-41(44)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h13,15,18-21,39H,4-12,14,16-17,22-37H2,1-3H3
InChIKey XONGHRNGCAWBDC-UHFFFAOYSA-N
Mol Weight 661.0 g/mol
Molecular Formula C41H72O6
Exact Mass 660.53289 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 AKmh6jRspZu
Name (3-acetoxy-2-octadeca-9,12-dienoyloxy-propyl) octadec-9-enoate
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 660.532890032 u
Formula C41H72O6
GC Column DB23 (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C41H72O6/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-40(43)46-37-39(36-45-38(3)42)47-41(44)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h13,15,18-21,39H,4-12,14,16-17,22-37H2,1-3H3
InChIKey XONGHRNGCAWBDC-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240190905
Molecular Weight 661.021 g/mol
SMILES C(COC(CCCCCCCC=CCCCCCCCC)=O)(COC(C)=O)OC(=O)CCCCCCCC=CCC=CCCCCC
SPLASH splash10-01si-0092000000-7401b22e59fbb9e35a20
Source of Spectrum HRC-19-500-Figure 2-3 (DOI: 10.1002/jhrc.1240190905)
Wiley ID 1911586