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L-Proline, N-heptafluorobutyryl-, undecyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-heptafluorobutyryl-, undecyl ester
SpectraBase Compound ID 6i2axtiQjIE
InChI InChI=1S/C20H30F7NO3/c1-2-3-4-5-6-7-8-9-10-14-31-16(29)15-12-11-13-28(15)17(30)18(21,22)19(23,24)20(25,26)27/h15H,2-14H2,1H3
InChIKey OQVONGCRLTXOFY-UHFFFAOYSA-N
Mol Weight 465.45 g/mol
Molecular Formula C20H30F7NO3
Exact Mass 465.211391 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9ckMDk10hQ
Name L-Proline, N-heptafluorobutyryl-, undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 465.211390968 u
Formula C20H30F7NO3
InChI InChI=1S/C20H30F7NO3/c1-2-3-4-5-6-7-8-9-10-14-31-16(29)15-12-11-13-28(15)17(30)18(21,22)19(23,24)20(25,26)27/h15H,2-14H2,1H3
InChIKey OQVONGCRLTXOFY-UHFFFAOYSA-N
Molecular Weight 465.453 g/mol
SMILES C1CC(C(=O)OCCCCCCCCCCC)N(C1)C(=O)C(C(C(F)(F)F)(F)F)(F)F