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

View entire compound with spectra: 1 NMR

L-Proline, N-(2,6-difluorobenzoyl)-, dodecyl ester
SpectraBase Compound ID Qv0qePGczl
InChI InChI=1S/C24H35F2NO3/c1-2-3-4-5-6-7-8-9-10-11-18-30-24(29)21-16-13-17-27(21)23(28)22-19(25)14-12-15-20(22)26/h12,14-15,21H,2-11,13,16-18H2,1H3
InChIKey VIFKTGWWWKJSEK-UHFFFAOYSA-N
Mol Weight 423.5 g/mol
Molecular Formula C24H35F2NO3
Exact Mass 423.2585 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EAInI6cGZ1d
Name L-Proline, N-(2,6-difluorobenzoyl)-, dodecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 423.258500314 u
Formula C24H35F2NO3
InChI InChI=1S/C24H35F2NO3/c1-2-3-4-5-6-7-8-9-10-11-18-30-24(29)21-16-13-17-27(21)23(28)22-19(25)14-12-15-20(22)26/h12,14-15,21H,2-11,13,16-18H2,1H3
InChIKey VIFKTGWWWKJSEK-UHFFFAOYSA-N
Molecular Weight 423.545 g/mol
SMILES C1=CC=C(C(=C1F)C(N1CCCC1C(=O)OCCCCCCCCCCCC)=O)F