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

*Links on SpectraBase are not permalinks.

.beta.-Alanine, N-benzyloxycarbonyl-, decyl ester

View entire compound with spectra: 1 NMR

.beta.-Alanine, N-benzyloxycarbonyl-, decyl ester
SpectraBase Compound ID Cao0q96Ddwt
InChI InChI=1S/C21H33NO4/c1-2-3-4-5-6-7-8-12-17-25-20(23)15-16-22-21(24)26-18-19-13-10-9-11-14-19/h9-11,13-14H,2-8,12,15-18H2,1H3,(H,22,24)
InChIKey VJGCGVCYCOTGBW-UHFFFAOYSA-N
Mol Weight 363.5 g/mol
Molecular Formula C21H33NO4
Exact Mass 363.240959 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 6RuTqwE0Fa0
Name .beta.-Alanine, N-benzyloxycarbonyl-, decyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.240958543 u
Formula C21H33NO4
InChI InChI=1S/C21H33NO4/c1-2-3-4-5-6-7-8-12-17-25-20(23)15-16-22-21(24)26-18-19-13-10-9-11-14-19/h9-11,13-14H,2-8,12,15-18H2,1H3,(H,22,24)
InChIKey VJGCGVCYCOTGBW-UHFFFAOYSA-N
Molecular Weight 363.498 g/mol
SMILES C1=CC=CC=C1COC(NCCC(OCCCCCCCCCC)=O)=O