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D-Proline, N-benzyloxycarbonyl-, propyl ester

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

D-Proline, N-benzyloxycarbonyl-, propyl ester
SpectraBase Compound ID BA4omempip7
InChI InChI=1S/C16H21NO4/c1-2-11-20-15(18)14-9-6-10-17(14)16(19)21-12-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12H2,1H3
InChIKey NIBYCPDGMGEEAE-UHFFFAOYSA-N
Mol Weight 291.35 g/mol
Molecular Formula C16H21NO4
Exact Mass 291.147058 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JRTMcxRACKU
Name D-Proline, N-benzyloxycarbonyl-, propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.147058156 u
Formula C16H21NO4
InChI InChI=1S/C16H21NO4/c1-2-11-20-15(18)14-9-6-10-17(14)16(19)21-12-13-7-4-3-5-8-13/h3-5,7-8,14H,2,6,9-12H2,1H3
InChIKey NIBYCPDGMGEEAE-UHFFFAOYSA-N
SMILES C1CCC(N1C(=O)OCC1=CC=CC=C1)C(=O)OCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.847023