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Fumaric acid, 2-dimethylaminoethyl hexadecyl ester

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Fumaric acid, 2-dimethylaminoethyl hexadecyl ester
SpectraBase Compound ID KG93vSsORYp
InChI InChI=1S/C24H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-28-23(26)18-19-24(27)29-22-20-25(2)3/h18-19H,4-17,20-22H2,1-3H3/b19-18+
InChIKey MXHDIPIRLPUXTP-VHEBQXMUSA-N
Mol Weight 411.6 g/mol
Molecular Formula C24H45NO4
Exact Mass 411.334859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5NwHe1wZ38
Name Fumaric acid, 2-dimethylaminoethyl hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 411.334858929 u
Formula C24H45NO4
InChI InChI=1S/C24H45NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-28-23(26)18-19-24(27)29-22-20-25(2)3/h18-19H,4-17,20-22H2,1-3H3/b19-18+
InChIKey MXHDIPIRLPUXTP-VHEBQXMUSA-N
Molecular Weight 411.627 g/mol
SMILES C(CCCCCCCCCOC(\C=C\C(OCCN(C)C)=O)=O)CCCCCC