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L-Proline, N-(2-methoxybenzoyl)-, heptyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(2-methoxybenzoyl)-, heptyl ester
SpectraBase Compound ID 6tcPU3aF1hJ
InChI InChI=1S/C20H29NO4/c1-3-4-5-6-9-15-25-20(23)17-12-10-14-21(17)19(22)16-11-7-8-13-18(16)24-2/h7-8,11,13,17H,3-6,9-10,12,14-15H2,1-2H3
InChIKey BBPKOSVRGQJWIT-UHFFFAOYSA-N
Mol Weight 347.46 g/mol
Molecular Formula C20H29NO4
Exact Mass 347.209658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7NDPY3jmpOi
Name L-Proline, N-(2-methoxybenzoyl)-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 347.209658414 u
Formula C20H29NO4
InChI InChI=1S/C20H29NO4/c1-3-4-5-6-9-15-25-20(23)17-12-10-14-21(17)19(22)16-11-7-8-13-18(16)24-2/h7-8,11,13,17H,3-6,9-10,12,14-15H2,1-2H3
InChIKey BBPKOSVRGQJWIT-UHFFFAOYSA-N
Molecular Weight 347.455 g/mol
SMILES C(N1CCCC1C(=O)OCCCCCCC)(=O)C1=C(C=CC=C1)OC