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

*Links on SpectraBase are not permalinks.

Succinic acid, tridec-2-yn-1-yl trans-hex-3-en-1-yl ester

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

Succinic acid, tridec-2-yn-1-yl trans-hex-3-en-1-yl ester
SpectraBase Compound ID 5vhf4NePWjc
InChI InChI=1S/C23H38O4/c1-3-5-7-9-10-11-12-13-14-15-17-21-27-23(25)19-18-22(24)26-20-16-8-6-4-2/h6,8H,3-5,7,9-14,16,18-21H2,1-2H3/b8-6+
InChIKey HZWRTEIZCVZLLG-SOFGYWHQSA-N
Mol Weight 378.6 g/mol
Molecular Formula C23H38O4
Exact Mass 378.27701 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 I3Er1X2hMvl
Name Succinic acid, tridec-2-yn-1-yl trans-hex-3-en-1-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 378.277009700 u
Formula C23H38O4
InChI InChI=1S/C23H38O4/c1-3-5-7-9-10-11-12-13-14-15-17-21-27-23(25)19-18-22(24)26-20-16-8-6-4-2/h6,8H,3-5,7,9-14,16,18-21H2,1-2H3/b8-6+
InChIKey HZWRTEIZCVZLLG-SOFGYWHQSA-N
Molecular Weight 378.553 g/mol
SMILES C(CC(OCC#CCCCCCCCCCC)=O)C(OCC\C=C\CC)=O