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L-Proline, N-(3-cyclopentylpropionyl)-, pentadecyl ester

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

L-Proline, N-(3-cyclopentylpropionyl)-, pentadecyl ester
SpectraBase Compound ID CHkVHLlSTOM
InChI InChI=1S/C28H51NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-24-32-28(31)26-20-17-23-29(26)27(30)22-21-25-18-14-15-19-25/h25-26H,2-24H2,1H3
InChIKey GIJRZGDOBJRHBG-UHFFFAOYSA-N
Mol Weight 449.7 g/mol
Molecular Formula C28H51NO3
Exact Mass 449.386895 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 32AElx6tse
Name L-Proline, N-(3-cyclopentylpropionyl)-, pentadecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 449.386894503 u
Formula C28H51NO3
InChI InChI=1S/C28H51NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-24-32-28(31)26-20-17-23-29(26)27(30)22-21-25-18-14-15-19-25/h25-26H,2-24H2,1H3
InChIKey GIJRZGDOBJRHBG-UHFFFAOYSA-N
Molecular Weight 449.720 g/mol
SMILES C(N1CCCC1C(=O)OCCCCCCCCCCCCCCC)(=O)CCC1CCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.930149