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L-Leucine, N-methyl-N-(2-(benzyloxy)ethoxycarbonyl)-, nonyl ester
SpectraBase Compound ID IICnt2torWq
InChI InChI=1S/C26H43NO5/c1-5-6-7-8-9-10-14-17-31-25(28)24(20-22(2)3)27(4)26(29)32-19-18-30-21-23-15-12-11-13-16-23/h11-13,15-16,22,24H,5-10,14,17-21H2,1-4H3/t24-/m0/s1
InChIKey GGDNSOVBEHVBJT-DEOSSOPVSA-N
Mol Weight 449.6 g/mol
Molecular Formula C26H43NO5
Exact Mass 449.314123 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Qd1Ac9yAjS
Name L-Leucine, N-methyl-N-(2-(benzyloxy)ethoxycarbonyl)-, nonyl ester
Comments Computed using HOSE algorithm
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Exact Mass 449.314123484 u
Formula C26H43NO5
InChI InChI=1S/C26H43NO5/c1-5-6-7-8-9-10-14-17-31-25(28)24(20-22(2)3)27(4)26(29)32-19-18-30-21-23-15-12-11-13-16-23/h11-13,15-16,22,24H,5-10,14,17-21H2,1-4H3/t24-/m0/s1
InChIKey GGDNSOVBEHVBJT-DEOSSOPVSA-N
Molecular Weight 449.632 g/mol
SMILES C(C)(C)C[C@@](C(OCCCCCCCCC)=O)(N(C)C(=O)OCCOCC1=CC=CC=C1)[H]