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L-Norvaline, N-((1R)-(-)-menthyloxycarbonyl)-, (1R)-(-)-menthyl ester
SpectraBase Compound ID 5vwVPGxZ5vj
InChI InChI=1S/C26H47NO4/c1-8-9-22(25(28)30-23-14-18(6)10-12-20(23)16(2)3)27-26(29)31-24-15-19(7)11-13-21(24)17(4)5/h16-24H,8-15H2,1-7H3,(H,27,29)
InChIKey FIZKQYDEMZRFCG-UHFFFAOYSA-N
Mol Weight 437.7 g/mol
Molecular Formula C26H47NO4
Exact Mass 437.350509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1rJqmcV7dSp
Name L-Norvaline, N-((1R)-(-)-menthyloxycarbonyl)-, (1R)-(-)-menthyl ester
Comments Computed using HOSE algorithm
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Exact Mass 437.350508993 u
Formula C26H47NO4
InChI InChI=1S/C26H47NO4/c1-8-9-22(25(28)30-23-14-18(6)10-12-20(23)16(2)3)27-26(29)31-24-15-19(7)11-13-21(24)17(4)5/h16-24H,8-15H2,1-7H3,(H,27,29)
InChIKey FIZKQYDEMZRFCG-UHFFFAOYSA-N
Molecular Weight 437.665 g/mol
SMILES CCCC(C(OC1CC(CCC1C(C)C)C)=O)NC(=O)OC1C(CCC(C1)C)C(C)C