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L-Leucine, N-benzyloxycarbonyl-, hexyl ester

View entire compound with spectra: 1 NMR

L-Leucine, N-benzyloxycarbonyl-, hexyl ester
SpectraBase Compound ID 1a7rPLWBUt5
InChI InChI=1S/C20H31NO4/c1-4-5-6-10-13-24-19(22)18(14-16(2)3)21-20(23)25-15-17-11-8-7-9-12-17/h7-9,11-12,16,18H,4-6,10,13-15H2,1-3H3,(H,21,23)
InChIKey FMRUKBAISZIAHT-UHFFFAOYSA-N
Mol Weight 349.47 g/mol
Molecular Formula C20H31NO4
Exact Mass 349.225308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7JDXgO9oeic
Name L-Leucine, N-benzyloxycarbonyl-, hexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.225308478 u
Formula C20H31NO4
InChI InChI=1S/C20H31NO4/c1-4-5-6-10-13-24-19(22)18(14-16(2)3)21-20(23)25-15-17-11-8-7-9-12-17/h7-9,11-12,16,18H,4-6,10,13-15H2,1-3H3,(H,21,23)
InChIKey FMRUKBAISZIAHT-UHFFFAOYSA-N
Molecular Weight 349.471 g/mol
SMILES C1=CC=CC=C1COC(NC(C(OCCCCCC)=O)CC(C)C)=O