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L-Valine, N-heptafluorobutyryl-, tetradecyl ester

View entire compound with spectra: 1 NMR

L-Valine, N-heptafluorobutyryl-, tetradecyl ester
SpectraBase Compound ID 9nGCdawBnD6
InChI InChI=1S/C23H38F7NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-34-19(32)18(17(2)3)31-20(33)21(24,25)22(26,27)23(28,29)30/h17-18H,4-16H2,1-3H3,(H,31,33)
InChIKey ACPKOSIGENDTLE-UHFFFAOYSA-N
Mol Weight 509.5 g/mol
Molecular Formula C23H38F7NO3
Exact Mass 509.273991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IpwlVOED0nn
Name L-Valine, N-heptafluorobutyryl-, tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 509.273991226 u
Formula C23H38F7NO3
InChI InChI=1S/C23H38F7NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-34-19(32)18(17(2)3)31-20(33)21(24,25)22(26,27)23(28,29)30/h17-18H,4-16H2,1-3H3,(H,31,33)
InChIKey ACPKOSIGENDTLE-UHFFFAOYSA-N
Molecular Weight 509.550 g/mol
SMILES CCCCCCCCCCCCCCOC(C(NC(C(C(C(F)(F)F)(F)F)(F)F)=O)C(C)C)=O