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L-Valine, N-pentafluoropropionyl-, pentadecyl ester

View entire compound with spectra: 1 NMR

L-Valine, N-pentafluoropropionyl-, pentadecyl ester
SpectraBase Compound ID HBQ1x5QOseM
InChI InChI=1S/C23H40F5NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-32-20(30)19(18(2)3)29-21(31)22(24,25)23(26,27)28/h18-19H,4-17H2,1-3H3,(H,29,31)
InChIKey HTYUIPVJJQHEQW-UHFFFAOYSA-N
Mol Weight 473.6 g/mol
Molecular Formula C23H40F5NO3
Exact Mass 473.292835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hgZdfC0ait
Name L-Valine, N-pentafluoropropionyl-, pentadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.292834964 u
Formula C23H40F5NO3
InChI InChI=1S/C23H40F5NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-32-20(30)19(18(2)3)29-21(31)22(24,25)23(26,27)28/h18-19H,4-17H2,1-3H3,(H,29,31)
InChIKey HTYUIPVJJQHEQW-UHFFFAOYSA-N
Molecular Weight 473.569 g/mol
SMILES CCCCCCCCCCCCCCCOC(C(NC(C(C(F)(F)F)(F)F)=O)C(C)C)=O