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Fumaric acid, dec-4-enyl hexadecyl ester

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Fumaric acid, dec-4-enyl hexadecyl ester
SpectraBase Compound ID 4cLFYY9RbVX
InChI InChI=1S/C30H54O4/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-28-34-30(32)26-25-29(31)33-27-23-21-19-12-10-8-6-4-2/h12,19,25-26H,3-11,13-18,20-24,27-28H2,1-2H3/b19-12+,26-25+
InChIKey HPGVPOJYSBDRGF-WISIHWMRSA-N
Mol Weight 478.8 g/mol
Molecular Formula C30H54O4
Exact Mass 478.40221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HtWiviNe0kI
Name Fumaric acid, dec-4-enyl hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 478.402210215 u
Formula C30H54O4
InChI InChI=1S/C30H54O4/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-28-34-30(32)26-25-29(31)33-27-23-21-19-12-10-8-6-4-2/h12,19,25-26H,3-11,13-18,20-24,27-28H2,1-2H3/b19-12+,26-25+
InChIKey HPGVPOJYSBDRGF-WISIHWMRSA-N
Molecular Weight 478.758 g/mol
SMILES C(OCCC\C=C\CCCCC)(\C=C\C(OCCCCCCCCCCCCCCCC)=O)=O