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Succinic acid, 3-methoxybenzyl tridecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 3-methoxybenzyl tridecyl ester
SpectraBase Compound ID 6O4qr0IRI1h
InChI InChI=1S/C25H40O5/c1-3-4-5-6-7-8-9-10-11-12-13-19-29-24(26)17-18-25(27)30-21-22-15-14-16-23(20-22)28-2/h14-16,20H,3-13,17-19,21H2,1-2H3
InChIKey KMSGFMHTGLJOBE-UHFFFAOYSA-N
Mol Weight 420.6 g/mol
Molecular Formula C25H40O5
Exact Mass 420.287574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JbYfX9PlUCA
Name Succinic acid, 3-methoxybenzyl tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 420.287574383 u
Formula C25H40O5
InChI InChI=1S/C25H40O5/c1-3-4-5-6-7-8-9-10-11-12-13-19-29-24(26)17-18-25(27)30-21-22-15-14-16-23(20-22)28-2/h14-16,20H,3-13,17-19,21H2,1-2H3
InChIKey KMSGFMHTGLJOBE-UHFFFAOYSA-N
Molecular Weight 420.590 g/mol
SMILES C(CCC(OCC=1C=C(C=CC1)OC)=O)(OCCCCCCCCCCCCC)=O