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Succinic acid, cyclohexylmethyl tetradec-3-en-1-yl ester

View entire compound with spectra: 1 NMR

Succinic acid, cyclohexylmethyl tetradec-3-en-1-yl ester
SpectraBase Compound ID 5rcVrGy0EW3
InChI InChI=1S/C25H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-16-21-28-24(26)19-20-25(27)29-22-23-17-14-13-15-18-23/h11-12,23H,2-10,13-22H2,1H3/b12-11+
InChIKey IPRONVXRICSEPL-VAWYXSNFSA-N
Mol Weight 408.6 g/mol
Molecular Formula C25H44O4
Exact Mass 408.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EX2vOXBkh0S
Name Succinic acid, cyclohexylmethyl tetradec-3-en-1-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 408.323959893 u
Formula C25H44O4
InChI InChI=1S/C25H44O4/c1-2-3-4-5-6-7-8-9-10-11-12-16-21-28-24(26)19-20-25(27)29-22-23-17-14-13-15-18-23/h11-12,23H,2-10,13-22H2,1H3/b12-11+
InChIKey IPRONVXRICSEPL-VAWYXSNFSA-N
Molecular Weight 408.623 g/mol
SMILES C(CC(OCC1CCCCC1)=O)C(OCC\C=C\CCCCCCCCCC)=O