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1,2-Cyclohexanedicarboxylic acid, 2-methoxyethyl pentadecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

1,2-Cyclohexanedicarboxylic acid, 2-methoxyethyl pentadecyl ester
SpectraBase Compound ID KuUz1uyTcze
InChI InChI=1S/C26H48O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-30-25(27)23-18-15-16-19-24(23)26(28)31-22-21-29-2/h23-24H,3-22H2,1-2H3
InChIKey UCFPIRSHJZVLHA-UHFFFAOYSA-N
Mol Weight 440.7 g/mol
Molecular Formula C26H48O5
Exact Mass 440.350175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GtbBLRGfITH
Name 1,2-Cyclohexanedicarboxylic acid, 2-methoxyethyl pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 440.350174641 u
Formula C26H48O5
InChI InChI=1S/C26H48O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-30-25(27)23-18-15-16-19-24(23)26(28)31-22-21-29-2/h23-24H,3-22H2,1-2H3
InChIKey UCFPIRSHJZVLHA-UHFFFAOYSA-N
Molecular Weight 440.665 g/mol
SMILES CCCCCCCCCCCCCCCOC(C1C(C(=O)OCCOC)CCCC1)=O