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Glutaric acid, 2-methylphenyl tridecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-methylphenyl tridecyl ester
SpectraBase Compound ID 6DDHwNqLLsN
InChI InChI=1S/C25H40O4/c1-3-4-5-6-7-8-9-10-11-12-15-21-28-24(26)19-16-20-25(27)29-23-18-14-13-17-22(23)2/h13-14,17-18H,3-12,15-16,19-21H2,1-2H3
InChIKey FAMAPRHDYDJSII-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C25H40O4
Exact Mass 404.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6IfWRHMxZHN
Name Glutaric acid, 2-methylphenyl tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 404.292659764 u
Formula C25H40O4
InChI InChI=1S/C25H40O4/c1-3-4-5-6-7-8-9-10-11-12-15-21-28-24(26)19-16-20-25(27)29-23-18-14-13-17-22(23)2/h13-14,17-18H,3-12,15-16,19-21H2,1-2H3
InChIKey FAMAPRHDYDJSII-UHFFFAOYSA-N
Molecular Weight 404.591 g/mol
SMILES CCCCCCCCCCCCCOC(CCCC(OC1=C(C=CC=C1)C)=O)=O