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Fumaric acid, allyl hexadecyl ester
SpectraBase Compound ID JsNwVlGoJv
InChI InChI=1S/C23H40O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-23(25)19-18-22(24)26-20-4-2/h4,18-19H,2-3,5-17,20-21H2,1H3/b19-18+
InChIKey DYRWLRHUIPTERM-VHEBQXMUSA-N
Mol Weight 380.6 g/mol
Molecular Formula C23H40O4
Exact Mass 380.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I392XcyOo9w
Name Fumaric acid, allyl hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 380.292659764 u
Formula C23H40O4
InChI InChI=1S/C23H40O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-23(25)19-18-22(24)26-20-4-2/h4,18-19H,2-3,5-17,20-21H2,1H3/b19-18+
InChIKey DYRWLRHUIPTERM-VHEBQXMUSA-N
Molecular Weight 380.569 g/mol
SMILES C(CCOC(\C=C\C(OCC=C)=O)=O)CCCCCCCCCCCCC