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Fumaric acid, 2,4-dimethylpent-3-yl nonadecyl ester

View entire compound with spectra: 1 NMR

Fumaric acid, 2,4-dimethylpent-3-yl nonadecyl ester
SpectraBase Compound ID 6NNxmDcedVc
InChI InChI=1S/C30H56O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-33-28(31)23-24-29(32)34-30(26(2)3)27(4)5/h23-24,26-27,30H,6-22,25H2,1-5H3/b24-23+
InChIKey ZTNYPYISBUVAPR-WCWDXBQESA-N
Mol Weight 480.8 g/mol
Molecular Formula C30H56O4
Exact Mass 480.41786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HUTqQsnzx7Q
Name Fumaric acid, 2,4-dimethylpent-3-yl nonadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 480.417860279 u
Formula C30H56O4
InChI InChI=1S/C30H56O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-33-28(31)23-24-29(32)34-30(26(2)3)27(4)5/h23-24,26-27,30H,6-22,25H2,1-5H3/b24-23+
InChIKey ZTNYPYISBUVAPR-WCWDXBQESA-N
Molecular Weight 480.774 g/mol
SMILES C(OC(C(C)C)C(C)C)(\C=C\C(OCCCCCCCCCCCCCCCCCCC)=O)=O