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L-Proline, N-(3-trifluoromethylbenzoyl)-, undecyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(3-trifluoromethylbenzoyl)-, undecyl ester
SpectraBase Compound ID J1CgKuQul4h
InChI InChI=1S/C24H34F3NO3/c1-2-3-4-5-6-7-8-9-10-17-31-23(30)21-15-12-16-28(21)22(29)19-13-11-14-20(18-19)24(25,26)27/h11,13-14,18,21H,2-10,12,15-17H2,1H3
InChIKey GDWNCQGPODCYLP-UHFFFAOYSA-N
Mol Weight 441.5 g/mol
Molecular Formula C24H34F3NO3
Exact Mass 441.249078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AilpXXWwbxo
Name L-Proline, N-(3-trifluoromethylbenzoyl)-, undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 441.249078445 u
Formula C24H34F3NO3
InChI InChI=1S/C24H34F3NO3/c1-2-3-4-5-6-7-8-9-10-17-31-23(30)21-15-12-16-28(21)22(29)19-13-11-14-20(18-19)24(25,26)27/h11,13-14,18,21H,2-10,12,15-17H2,1H3
InChIKey GDWNCQGPODCYLP-UHFFFAOYSA-N
Molecular Weight 441.535 g/mol
SMILES C1(=CC(=CC=C1)C(F)(F)F)C(N1CCCC1C(=O)OCCCCCCCCCCC)=O