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L-Proline, N-(3-methoxybenzoyl)-, dodecyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(3-methoxybenzoyl)-, dodecyl ester
SpectraBase Compound ID HRTHTgJdRyU
InChI InChI=1S/C25H39NO4/c1-3-4-5-6-7-8-9-10-11-12-19-30-25(28)23-17-14-18-26(23)24(27)21-15-13-16-22(20-21)29-2/h13,15-16,20,23H,3-12,14,17-19H2,1-2H3
InChIKey LVGYMCIVNHIBIQ-UHFFFAOYSA-N
Mol Weight 417.6 g/mol
Molecular Formula C25H39NO4
Exact Mass 417.287909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6GFQKzNCSQE
Name L-Proline, N-(3-methoxybenzoyl)-, dodecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 417.287908736 u
Formula C25H39NO4
InChI InChI=1S/C25H39NO4/c1-3-4-5-6-7-8-9-10-11-12-19-30-25(28)23-17-14-18-26(23)24(27)21-15-13-16-22(20-21)29-2/h13,15-16,20,23H,3-12,14,17-19H2,1-2H3
InChIKey LVGYMCIVNHIBIQ-UHFFFAOYSA-N
Molecular Weight 417.590 g/mol
SMILES C1(=CC=CC(=C1)C(N1CCCC1C(=O)OCCCCCCCCCCCC)=O)OC