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

View entire compound with spectra: 1 NMR

L-Proline, N-(2-methoxybenzoyl)-, tetradecyl ester
SpectraBase Compound ID Jl2vkvgmFY3
InChI InChI=1S/C27H43NO4/c1-3-4-5-6-7-8-9-10-11-12-13-16-22-32-27(30)24-19-17-21-28(24)26(29)23-18-14-15-20-25(23)31-2/h14-15,18,20,24H,3-13,16-17,19,21-22H2,1-2H3
InChIKey KHDTXXIFGSGMQN-UHFFFAOYSA-N
Mol Weight 445.6 g/mol
Molecular Formula C27H43NO4
Exact Mass 445.319209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KnF8gGxZSMM
Name L-Proline, N-(2-methoxybenzoyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 445.319208865 u
Formula C27H43NO4
InChI InChI=1S/C27H43NO4/c1-3-4-5-6-7-8-9-10-11-12-13-16-22-32-27(30)24-19-17-21-28(24)26(29)23-18-14-15-20-25(23)31-2/h14-15,18,20,24H,3-13,16-17,19,21-22H2,1-2H3
InChIKey KHDTXXIFGSGMQN-UHFFFAOYSA-N
Molecular Weight 445.644 g/mol
SMILES C(N1CCCC1C(=O)OCCCCCCCCCCCCCC)(=O)C1=C(C=CC=C1)OC