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Glutaric acid, cyclohexylmethyl heptadecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, cyclohexylmethyl heptadecyl ester
SpectraBase Compound ID 2NkiUhmEE5G
InChI InChI=1S/C29H54O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25-32-28(30)23-20-24-29(31)33-26-27-21-17-16-18-22-27/h27H,2-26H2,1H3
InChIKey IKKAWKVDRLQJQE-UHFFFAOYSA-N
Mol Weight 466.7 g/mol
Molecular Formula C29H54O4
Exact Mass 466.40221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FMXhsbyqCBC
Name Glutaric acid, cyclohexylmethyl heptadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 466.402210215 u
Formula C29H54O4
InChI InChI=1S/C29H54O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25-32-28(30)23-20-24-29(31)33-26-27-21-17-16-18-22-27/h27H,2-26H2,1H3
InChIKey IKKAWKVDRLQJQE-UHFFFAOYSA-N
Molecular Weight 466.747 g/mol
SMILES C(CCC(OCC1CCCCC1)=O)C(OCCCCCCCCCCCCCCCCC)=O