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Glutaric acid, 2-ethylhexyl 4-(4-methoxyphenyl)cyclohexyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 2-ethylhexyl 4-(4-methoxyphenyl)cyclohexyl ester
SpectraBase Compound ID LDOEr6KaJRm
InChI InChI=1S/C26H40O5/c1-4-6-8-20(5-2)19-30-25(27)9-7-10-26(28)31-24-17-13-22(14-18-24)21-11-15-23(29-3)16-12-21/h11-12,15-16,20,22,24H,4-10,13-14,17-19H2,1-3H3
InChIKey FAQUZKBKVVLIDA-UHFFFAOYSA-N
Mol Weight 432.6 g/mol
Molecular Formula C26H40O5
Exact Mass 432.287574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GXkigK5oMlz
Name Glutaric acid, 2-ethylhexyl 4-(4-methoxyphenyl)cyclohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 432.287574383 u
Formula C26H40O5
InChI InChI=1S/C26H40O5/c1-4-6-8-20(5-2)19-30-25(27)9-7-10-26(28)31-24-17-13-22(14-18-24)21-11-15-23(29-3)16-12-21/h11-12,15-16,20,22,24H,4-10,13-14,17-19H2,1-3H3
InChIKey FAQUZKBKVVLIDA-UHFFFAOYSA-N
Molecular Weight 432.601 g/mol
SMILES C(CCC(OCC(CC)CCCC)=O)C(OC1CCC(C2=CC=C(OC)C=C2)CC1)=O