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L-Proline, N-(2-fluorobenzoyl)-, dodecyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(2-fluorobenzoyl)-, dodecyl ester
SpectraBase Compound ID DWnZpDWXmzz
InChI InChI=1S/C24H36FNO3/c1-2-3-4-5-6-7-8-9-10-13-19-29-24(28)22-17-14-18-26(22)23(27)20-15-11-12-16-21(20)25/h11-12,15-16,22H,2-10,13-14,17-19H2,1H3
InChIKey HKMQSOKUPGVZHS-UHFFFAOYSA-N
Mol Weight 405.6 g/mol
Molecular Formula C24H36FNO3
Exact Mass 405.267922 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FVUp3OfAfo4
Name L-Proline, N-(2-fluorobenzoyl)-, dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 405.267922183 u
Formula C24H36FNO3
InChI InChI=1S/C24H36FNO3/c1-2-3-4-5-6-7-8-9-10-13-19-29-24(28)22-17-14-18-26(22)23(27)20-15-11-12-16-21(20)25/h11-12,15-16,22H,2-10,13-14,17-19H2,1H3
InChIKey HKMQSOKUPGVZHS-UHFFFAOYSA-N
Molecular Weight 405.554 g/mol
SMILES C1(=C(C=CC=C1)F)C(N1CCCC1C(=O)OCCCCCCCCCCCC)=O