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Fumaric acid, tetradecyl trans-hex-3-enyl ester

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Fumaric acid, tetradecyl trans-hex-3-enyl ester
SpectraBase Compound ID 4WX91z8f7aI
InChI InChI=1S/C24H42O4/c1-3-5-7-9-10-11-12-13-14-15-16-18-22-28-24(26)20-19-23(25)27-21-17-8-6-4-2/h6,8,19-20H,3-5,7,9-18,21-22H2,1-2H3/b8-6+,20-19+
InChIKey KKBXEHCLLYQXCD-CXIVGPKTSA-N
Mol Weight 394.6 g/mol
Molecular Formula C24H42O4
Exact Mass 394.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5eltoV8iaRb
Name Fumaric acid, tetradecyl trans-hex-3-enyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.308309828 u
Formula C24H42O4
InChI InChI=1S/C24H42O4/c1-3-5-7-9-10-11-12-13-14-15-16-18-22-28-24(26)20-19-23(25)27-21-17-8-6-4-2/h6,8,19-20H,3-5,7,9-18,21-22H2,1-2H3/b8-6+,20-19+
InChIKey KKBXEHCLLYQXCD-CXIVGPKTSA-N
Molecular Weight 394.596 g/mol
SMILES C(OCC\C=C\CC)(\C=C\C(OCCCCCCCCCCCCCC)=O)=O