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

*Links on SpectraBase are not permalinks.

Carbonic acid, monoamide, N-(2-phenylethyl)-N-(2-ethylhexyl)-, octyl ester

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

Carbonic acid, monoamide, N-(2-phenylethyl)-N-(2-ethylhexyl)-, octyl ester
SpectraBase Compound ID 60wVSORqkfM
InChI InChI=1S/C25H43NO2/c1-4-7-9-10-11-15-21-28-25(27)26(22-23(6-3)16-8-5-2)20-19-24-17-13-12-14-18-24/h12-14,17-18,23H,4-11,15-16,19-22H2,1-3H3
InChIKey SICOPUOPHVWYHZ-UHFFFAOYSA-N
Mol Weight 389.6 g/mol
Molecular Formula C25H43NO2
Exact Mass 389.32938 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 DdNYpFNlvXm
Name Carbonic acid, monoamide, N-(2-phenylethyl)-N-(2-ethylhexyl)-, octyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.329379627 u
Formula C25H43NO2
InChI InChI=1S/C25H43NO2/c1-4-7-9-10-11-15-21-28-25(27)26(22-23(6-3)16-8-5-2)20-19-24-17-13-12-14-18-24/h12-14,17-18,23H,4-11,15-16,19-22H2,1-3H3
InChIKey SICOPUOPHVWYHZ-UHFFFAOYSA-N
Molecular Weight 389.624 g/mol
SMILES C1=CC=CC(=C1)CCN(C(=O)OCCCCCCCC)CC(CCCC)CC