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Succinic acid, 3-methylphenyl pentadecyl ester
SpectraBase Compound ID 31vAAiyt7HE
InChI InChI=1S/C26H42O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-21-29-25(27)19-20-26(28)30-24-18-16-17-23(2)22-24/h16-18,22H,3-15,19-21H2,1-2H3
InChIKey KPFRNDICAKNXPY-UHFFFAOYSA-N
Mol Weight 418.6 g/mol
Molecular Formula C26H42O4
Exact Mass 418.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DUbhHDcvNWy
Name Succinic acid, 3-methylphenyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 418.308309828 u
Formula C26H42O4
InChI InChI=1S/C26H42O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-21-29-25(27)19-20-26(28)30-24-18-16-17-23(2)22-24/h16-18,22H,3-15,19-21H2,1-2H3
InChIKey KPFRNDICAKNXPY-UHFFFAOYSA-N
Molecular Weight 418.618 g/mol
SMILES C(CCCOC(CCC(OC1=CC=CC(C)=C1)=O)=O)CCCCCCCCCCC