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L-Proline, N-isopropyloxycarbonyl-, isopropyl ester

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

L-Proline, N-isopropyloxycarbonyl-, isopropyl ester
SpectraBase Compound ID L4gUSrmsRU1
InChI InChI=1S/C12H21NO4/c1-8(2)16-11(14)10-6-5-7-13(10)12(15)17-9(3)4/h8-10H,5-7H2,1-4H3
InChIKey JSSJFBXOSKHXLK-UHFFFAOYSA-N
Mol Weight 243.3 g/mol
Molecular Formula C12H21NO4
Exact Mass 243.147058 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LMsFVPlcleE
Name L-Proline, N-isopropyloxycarbonyl-, isopropyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 243.147058156 u
Formula C12H21NO4
InChI InChI=1S/C12H21NO4/c1-8(2)16-11(14)10-6-5-7-13(10)12(15)17-9(3)4/h8-10H,5-7H2,1-4H3
InChIKey JSSJFBXOSKHXLK-UHFFFAOYSA-N
Molecular Weight 243.303 g/mol
SMILES C(OC(C)C)(=O)C1CCCN1C(OC(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944452