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

View entire compound with spectra: 1 NMR

L-Proline, N-(3-methoxybenzoyl)-, nonyl ester
SpectraBase Compound ID 7jrPQwAPjxL
InChI InChI=1S/C22H33NO4/c1-3-4-5-6-7-8-9-16-27-22(25)20-14-11-15-23(20)21(24)18-12-10-13-19(17-18)26-2/h10,12-13,17,20H,3-9,11,14-16H2,1-2H3
InChIKey CXKIWHYZZKHWQM-UHFFFAOYSA-N
Mol Weight 375.5 g/mol
Molecular Formula C22H33NO4
Exact Mass 375.240959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8YT6dFvmKCI
Name L-Proline, N-(3-methoxybenzoyl)-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 375.240958543 u
Formula C22H33NO4
InChI InChI=1S/C22H33NO4/c1-3-4-5-6-7-8-9-16-27-22(25)20-14-11-15-23(20)21(24)18-12-10-13-19(17-18)26-2/h10,12-13,17,20H,3-9,11,14-16H2,1-2H3
InChIKey CXKIWHYZZKHWQM-UHFFFAOYSA-N
Molecular Weight 375.509 g/mol
SMILES C1(=CC=CC(=C1)C(N1CCCC1C(=O)OCCCCCCCCC)=O)OC