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

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L-Proline, N-(2-trifluoromethylbenzoyl)-, tetradecyl ester
SpectraBase Compound ID KtW32hEbctk
InChI InChI=1S/C27H40F3NO3/c1-2-3-4-5-6-7-8-9-10-11-12-15-21-34-26(33)24-19-16-20-31(24)25(32)22-17-13-14-18-23(22)27(28,29)30/h13-14,17-18,24H,2-12,15-16,19-21H2,1H3
InChIKey UNKOYVJDLDMLQN-UHFFFAOYSA-N
Mol Weight 483.6 g/mol
Molecular Formula C27H40F3NO3
Exact Mass 483.296029 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8B15jJLguhd
Name L-Proline, N-(2-trifluoromethylbenzoyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 483.296028638 u
Formula C27H40F3NO3
InChI InChI=1S/C27H40F3NO3/c1-2-3-4-5-6-7-8-9-10-11-12-15-21-34-26(33)24-19-16-20-31(24)25(32)22-17-13-14-18-23(22)27(28,29)30/h13-14,17-18,24H,2-12,15-16,19-21H2,1H3
InChIKey UNKOYVJDLDMLQN-UHFFFAOYSA-N
Molecular Weight 483.616 g/mol
SMILES C1(=C(C=CC=C1)C(F)(F)F)C(N1CCCC1C(=O)OCCCCCCCCCCCCCC)=O