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Succinic acid, hept-2-yl tetradec-3-en-1-yl ester

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

Succinic acid, hept-2-yl tetradec-3-en-1-yl ester
SpectraBase Compound ID LdZbX7tisQO
InChI InChI=1S/C25H46O4/c1-4-6-8-9-10-11-12-13-14-15-16-18-22-28-24(26)20-21-25(27)29-23(3)19-17-7-5-2/h15-16,23H,4-14,17-22H2,1-3H3/b16-15+
InChIKey PVUHSBFFPVTQSO-FOCLMDBBSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H46O4
Exact Mass 410.33961 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7N7oBEMl8f3
Name Succinic acid, hept-2-yl tetradec-3-en-1-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.339609957 u
Formula C25H46O4
InChI InChI=1S/C25H46O4/c1-4-6-8-9-10-11-12-13-14-15-16-18-22-28-24(26)20-21-25(27)29-23(3)19-17-7-5-2/h15-16,23H,4-14,17-22H2,1-3H3/b16-15+
InChIKey PVUHSBFFPVTQSO-FOCLMDBBSA-N
Molecular Weight 410.639 g/mol
SMILES C(CC(OC(C)CCCCC)=O)C(OCC\C=C\CCCCCCCCCC)=O