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Succinic acid, 4-methylbenzyl pentadecyl ester

View entire compound with spectra: 1 NMR

Succinic acid, 4-methylbenzyl pentadecyl ester
SpectraBase Compound ID K8vBEC7Jcoa
InChI InChI=1S/C27H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-30-26(28)20-21-27(29)31-23-25-18-16-24(2)17-19-25/h16-19H,3-15,20-23H2,1-2H3
InChIKey SJVNIGSFYVOERD-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C27H44O4
Exact Mass 432.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AnHWRW5MYxB
Name Succinic acid, 4-methylbenzyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 432.323959893 u
Formula C27H44O4
InChI InChI=1S/C27H44O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-30-26(28)20-21-27(29)31-23-25-18-16-24(2)17-19-25/h16-19H,3-15,20-23H2,1-2H3
InChIKey SJVNIGSFYVOERD-UHFFFAOYSA-N
Molecular Weight 432.645 g/mol
SMILES C(CCC(OCC=1C=CC(=CC1)C)=O)(OCCCCCCCCCCCCCCC)=O