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Glutaric acid, 2,4-dimethylpent-3-yl heptadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2,4-dimethylpent-3-yl heptadecyl ester
SpectraBase Compound ID Gp5G03B0s9l
InChI InChI=1S/C29H56O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-32-27(30)22-21-23-28(31)33-29(25(2)3)26(4)5/h25-26,29H,6-24H2,1-5H3
InChIKey LFWJAJOUXMVHKN-UHFFFAOYSA-N
Mol Weight 468.8 g/mol
Molecular Formula C29H56O4
Exact Mass 468.41786 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7kJOwG3Ons0
Name Glutaric acid, 2,4-dimethylpent-3-yl heptadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 468.417860279 u
Formula C29H56O4
InChI InChI=1S/C29H56O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-32-27(30)22-21-23-28(31)33-29(25(2)3)26(4)5/h25-26,29H,6-24H2,1-5H3
InChIKey LFWJAJOUXMVHKN-UHFFFAOYSA-N
Molecular Weight 468.763 g/mol
SMILES CC(C(OC(CCCC(OCCCCCCCCCCCCCCCCC)=O)=O)C(C)C)C