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

*Links on SpectraBase are not permalinks.

L-Proline, N-(3-methylbenzoyl)-, hexadecyl ester

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

L-Proline, N-(3-methylbenzoyl)-, hexadecyl ester
SpectraBase Compound ID DKZLgAYIipn
InChI InChI=1S/C29H47NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-33-29(32)27-21-18-22-30(27)28(31)26-20-17-19-25(2)24-26/h17,19-20,24,27H,3-16,18,21-23H2,1-2H3
InChIKey KHNLZNBIQOBQTD-UHFFFAOYSA-N
Mol Weight 457.7 g/mol
Molecular Formula C29H47NO3
Exact Mass 457.355594 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 5KHTcsIk1bw
Name L-Proline, N-(3-methylbenzoyl)-, hexadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.355594374 u
Formula C29H47NO3
InChI InChI=1S/C29H47NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-33-29(32)27-21-18-22-30(27)28(31)26-20-17-19-25(2)24-26/h17,19-20,24,27H,3-16,18,21-23H2,1-2H3
InChIKey KHNLZNBIQOBQTD-UHFFFAOYSA-N
Molecular Weight 457.699 g/mol
SMILES C1=C(C=CC=C1C)C(N1CCCC1C(=O)OCCCCCCCCCCCCCCCC)=O