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N-Benzyloxycarbonyl-dl-norleucine

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N-Benzyloxycarbonyl-dl-norleucine
SpectraBase Compound ID Lcl79T80ymx
InChI InChI=1S/2C14H19NO4/c2*1-2-3-9-12(13(16)17)15-14(18)19-10-11-7-5-4-6-8-11/h2*4-8,12H,2-3,9-10H2,1H3,(H,15,18)(H,16,17)
InChIKey FLSLTBDUGYLSDK-UHFFFAOYSA-N
Mol Weight 502.56 g/mol
Molecular Formula C26H34N2O8
Exact Mass 502.231516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7PpqSB1YjzV
Name N-Benzyloxycarbonyl-dl-norleucine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 502.231516055 u
Formula C26H34N2O8
InChI InChI=1S/2C14H19NO4/c2*1-2-3-9-12(13(16)17)15-14(18)19-10-11-7-5-4-6-8-11/h2*4-8,12H,2-3,9-10H2,1H3,(H,15,18)(H,16,17)
InChIKey FLSLTBDUGYLSDK-UHFFFAOYSA-N
Molecular Weight 502.564 g/mol
Nominal Mass 502 u
SMILES C=1C(=CC=CC1)COC(=O)NC(CCC)C(=O)O.C1=CC=CC=C1COC(NC(CCC)C(=O)O)=O