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L-Proline, N-(cyclopropylcarbonyl)-, octadecyl ester

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

L-Proline, N-(cyclopropylcarbonyl)-, octadecyl ester
SpectraBase Compound ID 6lpdbn9RTNg
InChI InChI=1S/C27H49NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-31-27(30)25-19-18-22-28(25)26(29)24-20-21-24/h24-25H,2-23H2,1H3
InChIKey HXHYWDNPESOVBV-UHFFFAOYSA-N
Mol Weight 435.7 g/mol
Molecular Formula C27H49NO3
Exact Mass 435.371244 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7Gh81JWJ9jF
Name L-Proline, N-(cyclopropylcarbonyl)-, octadecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 435.371244439 u
Formula C27H49NO3
InChI InChI=1S/C27H49NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-31-27(30)25-19-18-22-28(25)26(29)24-20-21-24/h24-25H,2-23H2,1H3
InChIKey HXHYWDNPESOVBV-UHFFFAOYSA-N
Molecular Weight 435.693 g/mol
SMILES C1(CC1)C(N1CCCC1C(=O)OCCCCCCCCCCCCCCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.905014