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

*Links on SpectraBase are not permalinks.

dl-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, hexadecyl ester

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

dl-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, hexadecyl ester
SpectraBase Compound ID 3C1zRhFpW05
InChI InChI=1S/C24H46ClNO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-29-23(27)22(2)26(3)24(28)30-21-18-19-25/h22H,4-21H2,1-3H3
InChIKey GJBINCPJPDLJQH-UHFFFAOYSA-N
Mol Weight 448.1 g/mol
Molecular Formula C24H46ClNO4
Exact Mass 447.311537 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 4bmw98x8cvM
Name dl-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, hexadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 447.311536661 u
Formula C24H46ClNO4
InChI InChI=1S/C24H46ClNO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-29-23(27)22(2)26(3)24(28)30-21-18-19-25/h22H,4-21H2,1-3H3
InChIKey GJBINCPJPDLJQH-UHFFFAOYSA-N
Molecular Weight 448.088 g/mol
SMILES CC(N(C)C(=O)OCCCCl)C(=O)OCCCCCCCCCCCCCCCC