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L-Proline, N-(4-chlorobenzoyl)-, undecyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(4-chlorobenzoyl)-, undecyl ester
SpectraBase Compound ID 8rV4vvZDbOS
InChI InChI=1S/C23H34ClNO3/c1-2-3-4-5-6-7-8-9-10-18-28-23(27)21-12-11-17-25(21)22(26)19-13-15-20(24)16-14-19/h13-16,21H,2-12,17-18H2,1H3
InChIKey JPJJUDSPPDPNCK-UHFFFAOYSA-N
Mol Weight 408.0 g/mol
Molecular Formula C23H34ClNO3
Exact Mass 407.222722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GaT6wO0ndos
Name L-Proline, N-(4-chlorobenzoyl)-, undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 407.222721656 u
Formula C23H34ClNO3
InChI InChI=1S/C23H34ClNO3/c1-2-3-4-5-6-7-8-9-10-18-28-23(27)21-12-11-17-25(21)22(26)19-13-15-20(24)16-14-19/h13-16,21H,2-12,17-18H2,1H3
InChIKey JPJJUDSPPDPNCK-UHFFFAOYSA-N
Molecular Weight 407.982 g/mol
SMILES C1C(N(C(=O)C2=CC=C(C=C2)Cl)CC1)C(=O)OCCCCCCCCCCC