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L-Leucine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, tridecyl ester
SpectraBase Compound ID HBJGFWqY0qB
InChI InChI=1S/C31H59NO4/c1-8-9-10-11-12-13-14-15-16-17-18-21-35-30(33)28(22-24(2)3)32(7)31(34)36-29-23-26(6)19-20-27(29)25(4)5/h24-29H,8-23H2,1-7H3
InChIKey IEACPNHLZRUODK-UHFFFAOYSA-N
Mol Weight 509.8 g/mol
Molecular Formula C31H59NO4
Exact Mass 509.444409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BJD0UXRiUSO
Name L-Leucine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, tridecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 509.444409380 u
Formula C31H59NO4
InChI InChI=1S/C31H59NO4/c1-8-9-10-11-12-13-14-15-16-17-18-21-35-30(33)28(22-24(2)3)32(7)31(34)36-29-23-26(6)19-20-27(29)25(4)5/h24-29H,8-23H2,1-7H3
InChIKey IEACPNHLZRUODK-UHFFFAOYSA-N
Molecular Weight 509.816 g/mol
SMILES C(C)(C)CC(N(C)C(=O)OC1C(C(C)C)CCC(C)C1)C(OCCCCCCCCCCCCC)=O