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(Z)-(Z)-Icos-11-en-1-yl icos-11-enoate

View entire compound with spectra: 1 NMR, and 1 FTIR

(Z)-(Z)-Icos-11-en-1-yl icos-11-enoate
SpectraBase Compound ID 25nPRrLADdv
InChI InChI=1S/C40H76O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-42-40(41)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-39H2,1-2H3/b19-17-,20-18-
InChIKey JZPSREGMTSRPQU-CLFAGFIQSA-N
Mol Weight 589.0 g/mol
Molecular Formula C40H76O2
Exact Mass 588.584532 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4hQZKgJ24B5
Name (Z)-(Z)-Icos-11-en-1-yl icos-11-enoate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 588.584531685 u
Formula C40H76O2
InChI InChI=1S/C40H76O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-42-40(41)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20H,3-16,21-39H2,1-2H3/b19-17-,20-18-
InChIKey JZPSREGMTSRPQU-CLFAGFIQSA-N
Molecular Weight 589.046 g/mol
SMILES C(CCCCCCCCC\C=C/CCCCCCCC)(=O)OCCCCCCCCCC\C=C/CCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.946371