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

*Links on SpectraBase are not permalinks.

L-Alanine, N-(2-trifluoromethylbenzoyl)-, tetradecyl ester

View entire compound with spectra: 1 NMR

L-Alanine, N-(2-trifluoromethylbenzoyl)-, tetradecyl ester
SpectraBase Compound ID xvjYxN2MLq
InChI InChI=1S/C25H38F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-16-19-32-24(31)20(2)29-23(30)21-17-14-15-18-22(21)25(26,27)28/h14-15,17-18,20H,3-13,16,19H2,1-2H3,(H,29,30)
InChIKey QFVOQROVZWZIOB-UHFFFAOYSA-N
Mol Weight 457.6 g/mol
Molecular Formula C25H38F3NO3
Exact Mass 457.280379 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 NU54xgArM0
Name L-Alanine, N-(2-trifluoromethylbenzoyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.280378574 u
Formula C25H38F3NO3
InChI InChI=1S/C25H38F3NO3/c1-3-4-5-6-7-8-9-10-11-12-13-16-19-32-24(31)20(2)29-23(30)21-17-14-15-18-22(21)25(26,27)28/h14-15,17-18,20H,3-13,16,19H2,1-2H3,(H,29,30)
InChIKey QFVOQROVZWZIOB-UHFFFAOYSA-N
Molecular Weight 457.578 g/mol
SMILES C1(=CC=CC=C1C(NC(C(OCCCCCCCCCCCCCC)=O)C)=O)C(F)(F)F