For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Adipic acid, monoamide, N,N-di(2-ethylhexyl)-, octyl ester
SpectraBase Compound ID EloZ6MaqMgG
InChI InChI=1S/C30H59NO3/c1-6-11-14-15-16-19-24-34-30(33)23-18-17-22-29(32)31(25-27(9-4)20-12-7-2)26-28(10-5)21-13-8-3/h27-28H,6-26H2,1-5H3
InChIKey REJJYWXKRCGMKD-UHFFFAOYSA-N
Mol Weight 481.8 g/mol
Molecular Formula C30H59NO3
Exact Mass 481.449495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LkYZTOdWI5q
Name Adipic acid, monoamide, N,N-di(2-ethylhexyl)-, octyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.449494761 u
Formula C30H59NO3
InChI InChI=1S/C30H59NO3/c1-6-11-14-15-16-19-24-34-30(33)23-18-17-22-29(32)31(25-27(9-4)20-12-7-2)26-28(10-5)21-13-8-3/h27-28H,6-26H2,1-5H3
InChIKey REJJYWXKRCGMKD-UHFFFAOYSA-N
Molecular Weight 481.806 g/mol
SMILES C(=O)(CCCCC(OCCCCCCCC)=O)N(CC(CC)CCCC)CC(CCCC)CC