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

View entire compound with spectra: 1 NMR

L-Alanine, N-(2-fluorobenzoyl)-, tetradecyl ester
SpectraBase Compound ID Ci47gROnpXV
InChI InChI=1S/C24H38FNO3/c1-3-4-5-6-7-8-9-10-11-12-13-16-19-29-24(28)20(2)26-23(27)21-17-14-15-18-22(21)25/h14-15,17-18,20H,3-13,16,19H2,1-2H3,(H,26,27)
InChIKey OWCCDSBOWBJPDQ-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C24H38FNO3
Exact Mass 407.283572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D5phuJfArA2
Name L-Alanine, N-(2-fluorobenzoyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.283572248 u
Formula C24H38FNO3
InChI InChI=1S/C24H38FNO3/c1-3-4-5-6-7-8-9-10-11-12-13-16-19-29-24(28)20(2)26-23(27)21-17-14-15-18-22(21)25/h14-15,17-18,20H,3-13,16,19H2,1-2H3,(H,26,27)
InChIKey OWCCDSBOWBJPDQ-UHFFFAOYSA-N
Molecular Weight 407.570 g/mol
SMILES C1=CC=CC(=C1C(NC(C(OCCCCCCCCCCCCCC)=O)C)=O)F