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L-Norleucine, N-benzyloxycarbonyl-, pentyl ester

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

L-Norleucine, N-benzyloxycarbonyl-, pentyl ester
SpectraBase Compound ID 72khPIleeE7
InChI InChI=1S/C19H29NO4/c1-3-5-10-14-23-18(21)17(13-6-4-2)20-19(22)24-15-16-11-8-7-9-12-16/h7-9,11-12,17H,3-6,10,13-15H2,1-2H3,(H,20,22)
InChIKey OFZFAUMHUUEZDR-UHFFFAOYSA-N
Mol Weight 335.44 g/mol
Molecular Formula C19H29NO4
Exact Mass 335.209658 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1ViUM9JbnOm
Name L-Norleucine, N-benzyloxycarbonyl-, pentyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 335.209658414 u
Formula C19H29NO4
InChI InChI=1S/C19H29NO4/c1-3-5-10-14-23-18(21)17(13-6-4-2)20-19(22)24-15-16-11-8-7-9-12-16/h7-9,11-12,17H,3-6,10,13-15H2,1-2H3,(H,20,22)
InChIKey OFZFAUMHUUEZDR-UHFFFAOYSA-N
Molecular Weight 335.444 g/mol
SMILES CCCCCOC(C(NC(OCC=1C=CC=CC1)=O)CCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.825317