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L-Norvalyl-L-norvaline, N-benzyloxycarbonyl-, pentyl ester
SpectraBase Compound ID 7gL5n6NkRJB
InChI InChI=1S/C23H36N2O5/c1-4-7-11-16-29-22(27)20(13-6-3)24-21(26)19(12-5-2)25-23(28)30-17-18-14-9-8-10-15-18/h8-10,14-15,19-20H,4-7,11-13,16-17H2,1-3H3,(H,24,26)(H,25,28)
InChIKey IRLZPPPTPKTPJF-UHFFFAOYSA-N
Mol Weight 420.6 g/mol
Molecular Formula C23H36N2O5
Exact Mass 420.262422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gzj90DMdwWf
Name L-Norvalyl-L-norvaline, N-benzyloxycarbonyl-, pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 420.262422262 u
Formula C23H36N2O5
InChI InChI=1S/C23H36N2O5/c1-4-7-11-16-29-22(27)20(13-6-3)24-21(26)19(12-5-2)25-23(28)30-17-18-14-9-8-10-15-18/h8-10,14-15,19-20H,4-7,11-13,16-17H2,1-3H3,(H,24,26)(H,25,28)
InChIKey IRLZPPPTPKTPJF-UHFFFAOYSA-N
Molecular Weight 420.550 g/mol
SMILES C1(=CC=CC=C1)COC(NC(C(NC(CCC)C(OCCCCC)=O)=O)CCC)=O