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L-Proline, N-(3-phenylpropionyl)-, decyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

L-Proline, N-(3-phenylpropionyl)-, decyl ester
SpectraBase Compound ID 4noK7E2xLx7
InChI InChI=1S/C24H37NO3/c1-2-3-4-5-6-7-8-12-20-28-24(27)22-16-13-19-25(22)23(26)18-17-21-14-10-9-11-15-21/h9-11,14-15,22H,2-8,12-13,16-20H2,1H3
InChIKey VTKPPXBBDHGUSS-UHFFFAOYSA-N
Mol Weight 387.6 g/mol
Molecular Formula C24H37NO3
Exact Mass 387.277344 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HD3L47vwz0l
Name L-Proline, N-(3-phenylpropionyl)-, decyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 387.277344052 u
Formula C24H37NO3
InChI InChI=1S/C24H37NO3/c1-2-3-4-5-6-7-8-12-20-28-24(27)22-16-13-19-25(22)23(26)18-17-21-14-10-9-11-15-21/h9-11,14-15,22H,2-8,12-13,16-20H2,1H3
InChIKey VTKPPXBBDHGUSS-UHFFFAOYSA-N
Molecular Weight 387.564 g/mol
SMILES C1=CC=CC(=C1)CCC(N1CCCC1C(=O)OCCCCCCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.821903