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Adipic acid, nonyl 2-propylphenyl ester
SpectraBase Compound ID 6iXP8AhT0Mb
InChI InChI=1S/C24H38O4/c1-3-5-6-7-8-9-14-20-27-23(25)18-12-13-19-24(26)28-22-17-11-10-16-21(22)15-4-2/h10-11,16-17H,3-9,12-15,18-20H2,1-2H3
InChIKey HUGFDNUAQXSUCZ-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ASZJfFQGD7p
Name Adipic acid, nonyl 2-propylphenyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.277009700 u
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-3-5-6-7-8-9-14-20-27-23(25)18-12-13-19-24(26)28-22-17-11-10-16-21(22)15-4-2/h10-11,16-17H,3-9,12-15,18-20H2,1-2H3
InChIKey HUGFDNUAQXSUCZ-UHFFFAOYSA-N
Molecular Weight 390.564 g/mol
SMILES C(CCCC(OC=1C(CCC)=CC=CC1)=O)C(OCCCCCCCCC)=O