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L-Proline, N-(4-fluorobenzoyl)-, decyl ester
SpectraBase Compound ID 2EAyG257uoF
InChI InChI=1S/C22H32FNO3/c1-2-3-4-5-6-7-8-9-17-27-22(26)20-11-10-16-24(20)21(25)18-12-14-19(23)15-13-18/h12-15,20H,2-11,16-17H2,1H3
InChIKey YOVFXSKAMXNERO-UHFFFAOYSA-N
Mol Weight 377.5 g/mol
Molecular Formula C22H32FNO3
Exact Mass 377.236622 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FyH3LEMaOx8
Name L-Proline, N-(4-fluorobenzoyl)-, decyl ester
Comments Computed using HOSE algorithm
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Exact Mass 377.236622054 u
Formula C22H32FNO3
InChI InChI=1S/C22H32FNO3/c1-2-3-4-5-6-7-8-9-17-27-22(26)20-11-10-16-24(20)21(25)18-12-14-19(23)15-13-18/h12-15,20H,2-11,16-17H2,1H3
InChIKey YOVFXSKAMXNERO-UHFFFAOYSA-N
Molecular Weight 377.500 g/mol
SMILES C1C(N(C(=O)C2=CC=C(C=C2)F)CC1)C(=O)OCCCCCCCCCC