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L-Leucine, N-benzyloxycarbonyl-, propyl ester

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

L-Leucine, N-benzyloxycarbonyl-, propyl ester
SpectraBase Compound ID GRxN5c0z5cK
InChI InChI=1S/C17H25NO4/c1-4-10-21-16(19)15(11-13(2)3)18-17(20)22-12-14-8-6-5-7-9-14/h5-9,13,15H,4,10-12H2,1-3H3,(H,18,20)
InChIKey LICYRAWJEFFTDI-UHFFFAOYSA-N
Mol Weight 307.39 g/mol
Molecular Formula C17H25NO4
Exact Mass 307.178358 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5p7X0IbrXCT
Name L-Leucine, N-benzyloxycarbonyl-, propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.178358285 u
Formula C17H25NO4
InChI InChI=1S/C17H25NO4/c1-4-10-21-16(19)15(11-13(2)3)18-17(20)22-12-14-8-6-5-7-9-14/h5-9,13,15H,4,10-12H2,1-3H3,(H,18,20)
InChIKey LICYRAWJEFFTDI-UHFFFAOYSA-N
Molecular Weight 307.390 g/mol
SMILES C1=CC(=CC=C1)COC(NC(CC(C)C)C(OCCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.952806