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L-Proline, N-(2,6-difluorobenzoyl)-, decyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(2,6-difluorobenzoyl)-, decyl ester
SpectraBase Compound ID BGBKYxyz62k
InChI InChI=1S/C22H31F2NO3/c1-2-3-4-5-6-7-8-9-16-28-22(27)19-14-11-15-25(19)21(26)20-17(23)12-10-13-18(20)24/h10,12-13,19H,2-9,11,14-16H2,1H3
InChIKey FWPFSPYTXPQWLT-UHFFFAOYSA-N
Mol Weight 395.49 g/mol
Molecular Formula C22H31F2NO3
Exact Mass 395.2272 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HNpYeC0UUrp
Name L-Proline, N-(2,6-difluorobenzoyl)-, decyl ester
Comments Computed using HOSE algorithm
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Exact Mass 395.227200185 u
Formula C22H31F2NO3
InChI InChI=1S/C22H31F2NO3/c1-2-3-4-5-6-7-8-9-16-28-22(27)19-14-11-15-25(19)21(26)20-17(23)12-10-13-18(20)24/h10,12-13,19H,2-9,11,14-16H2,1H3
InChIKey FWPFSPYTXPQWLT-UHFFFAOYSA-N
Molecular Weight 395.491 g/mol
SMILES C1(=C(C(=CC=C1)F)C(N1CCCC1C(=O)OCCCCCCCCCC)=O)F