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

*Links on SpectraBase are not permalinks.

6-Aminocaproic acid, N-butoxycarbonyl-, pentadecyl ester

View entire compound with spectra: 1 NMR

6-Aminocaproic acid, N-butoxycarbonyl-, pentadecyl ester
SpectraBase Compound ID 4Jc3D1qmjll
InChI InChI=1S/C26H51NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-20-24-30-25(28)21-18-17-19-22-27-26(29)31-23-6-4-2/h3-24H2,1-2H3,(H,27,29)
InChIKey HGRGPZNSRZYMTA-UHFFFAOYSA-N
Mol Weight 441.7 g/mol
Molecular Formula C26H51NO4
Exact Mass 441.381809 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 2baSr4kOpMu
Name 6-Aminocaproic acid, N-butoxycarbonyl-, pentadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 441.381809122 u
Formula C26H51NO4
InChI InChI=1S/C26H51NO4/c1-3-5-7-8-9-10-11-12-13-14-15-16-20-24-30-25(28)21-18-17-19-22-27-26(29)31-23-6-4-2/h3-24H2,1-2H3,(H,27,29)
InChIKey HGRGPZNSRZYMTA-UHFFFAOYSA-N
Molecular Weight 441.697 g/mol
SMILES CCCCOC(NCCCCCC(OCCCCCCCCCCCCCCC)=O)=O