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

*Links on SpectraBase are not permalinks.

.beta.-Alanine, N-(2-chlorobenzoyl)-, tetradecyl ester

View entire compound with spectra: 1 NMR

.beta.-Alanine, N-(2-chlorobenzoyl)-, tetradecyl ester
SpectraBase Compound ID 1ZUFaBx2uEF
InChI InChI=1S/C24H38ClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-15-20-29-23(27)18-19-26-24(28)21-16-13-14-17-22(21)25/h13-14,16-17H,2-12,15,18-20H2,1H3,(H,26,28)
InChIKey WGEPOKJCBMIFIN-UHFFFAOYSA-N
Mol Weight 424.0 g/mol
Molecular Formula C24H38ClNO3
Exact Mass 423.254022 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 6hPe6ZRDPr2
Name .beta.-Alanine, N-(2-chlorobenzoyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 423.254021785 u
Formula C24H38ClNO3
InChI InChI=1S/C24H38ClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-15-20-29-23(27)18-19-26-24(28)21-16-13-14-17-22(21)25/h13-14,16-17H,2-12,15,18-20H2,1H3,(H,26,28)
InChIKey WGEPOKJCBMIFIN-UHFFFAOYSA-N
Molecular Weight 424.025 g/mol
SMILES C1=CC=CC(=C1C(NCCC(OCCCCCCCCCCCCCC)=O)=O)Cl