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

*Links on SpectraBase are not permalinks.
L-Valine, N-pentafluoropropionyl-, tetradecyl ester
SpectraBase Compound ID 6WXGPnoaj1Q
InChI InChI=1S/C22H38F5NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-31-19(29)18(17(2)3)28-20(30)21(23,24)22(25,26)27/h17-18H,4-16H2,1-3H3,(H,28,30)
InChIKey YHZIQORKOBTBCB-UHFFFAOYSA-N
Mol Weight 459.5 g/mol
Molecular Formula C22H38F5NO3
Exact Mass 459.277185 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 mwkJXoMd36
Name L-Valine, N-pentafluoropropionyl-, tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 459.277184900 u
Formula C22H38F5NO3
InChI InChI=1S/C22H38F5NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-31-19(29)18(17(2)3)28-20(30)21(23,24)22(25,26)27/h17-18H,4-16H2,1-3H3,(H,28,30)
InChIKey YHZIQORKOBTBCB-UHFFFAOYSA-N
Molecular Weight 459.542 g/mol
SMILES CCCCCCCCCCCCCCOC(C(NC(C(C(F)(F)F)(F)F)=O)C(C)C)=O