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

View entire compound with spectra: 1 NMR

L-Proline, N-(2-trifluoromethylbenzoyl)-, butyl ester
SpectraBase Compound ID 3zOWu0bYRbe
InChI InChI=1S/C17H20F3NO3/c1-2-3-11-24-16(23)14-9-6-10-21(14)15(22)12-7-4-5-8-13(12)17(18,19)20/h4-5,7-8,14H,2-3,6,9-11H2,1H3
InChIKey RIQAFXKUPJZLTM-UHFFFAOYSA-N
Mol Weight 343.35 g/mol
Molecular Formula C17H20F3NO3
Exact Mass 343.139528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FIH78c66Ka6
Name L-Proline, N-(2-trifluoromethylbenzoyl)-, butyl ester
Comments Computed using HOSE algorithm
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Exact Mass 343.139527994 u
Formula C17H20F3NO3
InChI InChI=1S/C17H20F3NO3/c1-2-3-11-24-16(23)14-9-6-10-21(14)15(22)12-7-4-5-8-13(12)17(18,19)20/h4-5,7-8,14H,2-3,6,9-11H2,1H3
InChIKey RIQAFXKUPJZLTM-UHFFFAOYSA-N
Molecular Weight 343.346 g/mol
SMILES C1(=C(C=CC=C1)C(F)(F)F)C(N1CCCC1C(OCCCC)=O)=O