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L-Proline, N-(pentafluorobenzoyl)-, tetradecyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(pentafluorobenzoyl)-, tetradecyl ester
SpectraBase Compound ID H6QHl0xQRku
InChI InChI=1S/C26H36F5NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-35-26(34)18-15-14-16-32(18)25(33)19-20(27)22(29)24(31)23(30)21(19)28/h18H,2-17H2,1H3
InChIKey GUZISAIESKIJLG-UHFFFAOYSA-N
Mol Weight 505.6 g/mol
Molecular Formula C26H36F5NO3
Exact Mass 505.261535 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GDf0zY2EobA
Name L-Proline, N-(pentafluorobenzoyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 505.261534835 u
Formula C26H36F5NO3
InChI InChI=1S/C26H36F5NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-35-26(34)18-15-14-16-32(18)25(33)19-20(27)22(29)24(31)23(30)21(19)28/h18H,2-17H2,1H3
InChIKey GUZISAIESKIJLG-UHFFFAOYSA-N
Molecular Weight 505.570 g/mol
SMILES C1(=C(C(=C(C(=C1F)F)F)F)F)C(N1CCCC1C(=O)OCCCCCCCCCCCCCC)=O