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L-Norvaline, N-benzyloxycarbonyl-, pentadecyl ester

View entire compound with spectra: 1 NMR

L-Norvaline, N-benzyloxycarbonyl-, pentadecyl ester
SpectraBase Compound ID AKLc2JKGbBK
InChI InChI=1S/C28H47NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-23-32-27(30)26(20-4-2)29-28(31)33-24-25-21-17-16-18-22-25/h16-18,21-22,26H,3-15,19-20,23-24H2,1-2H3,(H,29,31)
InChIKey XAXXYCYBWWPQCG-UHFFFAOYSA-N
Mol Weight 461.7 g/mol
Molecular Formula C28H47NO4
Exact Mass 461.350509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3Hla6IEHpd
Name L-Norvaline, N-benzyloxycarbonyl-, pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 461.350508993 u
Formula C28H47NO4
InChI InChI=1S/C28H47NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-23-32-27(30)26(20-4-2)29-28(31)33-24-25-21-17-16-18-22-25/h16-18,21-22,26H,3-15,19-20,23-24H2,1-2H3,(H,29,31)
InChIKey XAXXYCYBWWPQCG-UHFFFAOYSA-N
Molecular Weight 461.687 g/mol
SMILES C1=CC=CC(=C1)COC(NC(C(OCCCCCCCCCCCCCCC)=O)CCC)=O