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

*Links on SpectraBase are not permalinks.

L-Leucine, N-(2-trifluoromethylbenzoyl)-, hexadecyl ester

View entire compound with spectra: 1 NMR

L-Leucine, N-(2-trifluoromethylbenzoyl)-, hexadecyl ester
SpectraBase Compound ID Cur0bIoxNuB
InChI InChI=1S/C30H48F3NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-37-29(36)27(23-24(2)3)34-28(35)25-20-17-18-21-26(25)30(31,32)33/h17-18,20-21,24,27H,4-16,19,22-23H2,1-3H3,(H,34,35)
InChIKey JZLXVYGYFJRNGI-UHFFFAOYSA-N
Mol Weight 527.7 g/mol
Molecular Formula C30H48F3NO3
Exact Mass 527.358629 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 IgcaN9qih1H
Name L-Leucine, N-(2-trifluoromethylbenzoyl)-, hexadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 527.358628896 u
Formula C30H48F3NO3
InChI InChI=1S/C30H48F3NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-37-29(36)27(23-24(2)3)34-28(35)25-20-17-18-21-26(25)30(31,32)33/h17-18,20-21,24,27H,4-16,19,22-23H2,1-3H3,(H,34,35)
InChIKey JZLXVYGYFJRNGI-UHFFFAOYSA-N
Molecular Weight 527.713 g/mol
SMILES C1=CC=CC(=C1C(NC(C(OCCCCCCCCCCCCCCCC)=O)CC(C)C)=O)C(F)(F)F