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Fumaric acid, 3,5-dimethylphenyl dodec-2-en-1-yl ester

View entire compound with spectra: 1 NMR

Fumaric acid, 3,5-dimethylphenyl dodec-2-en-1-yl ester
SpectraBase Compound ID ByULsds7JIz
InChI InChI=1S/C24H34O4/c1-4-5-6-7-8-9-10-11-12-13-16-27-23(25)14-15-24(26)28-22-18-20(2)17-21(3)19-22/h12-15,17-19H,4-11,16H2,1-3H3/b13-12+,15-14+
InChIKey AEFAUOCCFJSWSU-SQIWNDBBSA-N
Mol Weight 386.5 g/mol
Molecular Formula C24H34O4
Exact Mass 386.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 635apRiXTQI
Name Fumaric acid, 3,5-dimethylphenyl dodec-2-en-1-yl ester
Comments Computed using HOSE algorithm
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Exact Mass 386.245709571 u
Formula C24H34O4
InChI InChI=1S/C24H34O4/c1-4-5-6-7-8-9-10-11-12-13-16-27-23(25)14-15-24(26)28-22-18-20(2)17-21(3)19-22/h12-15,17-19H,4-11,16H2,1-3H3/b13-12+,15-14+
InChIKey AEFAUOCCFJSWSU-SQIWNDBBSA-N
Molecular Weight 386.532 g/mol
SMILES C(\C=C\C(OC\C=C\CCCCCCCCC)=O)(OC1=CC(=CC(=C1)C)C)=O