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dl-Alanine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, undecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

dl-Alanine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, undecyl ester
SpectraBase Compound ID 8ddzENW5g2g
InChI InChI=1S/C26H49NO4/c1-7-8-9-10-11-12-13-14-15-18-30-25(28)22(5)27(6)26(29)31-24-19-21(4)16-17-23(24)20(2)3/h20-24H,7-19H2,1-6H3
InChIKey KHNCDUIRDQIRHQ-UHFFFAOYSA-N
Mol Weight 439.7 g/mol
Molecular Formula C26H49NO4
Exact Mass 439.366159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CQroUYU5hXE
Name dl-Alanine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, undecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 439.366159058 u
Formula C26H49NO4
InChI InChI=1S/C26H49NO4/c1-7-8-9-10-11-12-13-14-15-18-30-25(28)22(5)27(6)26(29)31-24-19-21(4)16-17-23(24)20(2)3/h20-24H,7-19H2,1-6H3
InChIKey KHNCDUIRDQIRHQ-UHFFFAOYSA-N
Molecular Weight 439.681 g/mol
SMILES CC(N(C)C(=O)OC1C(C(C)C)CCC(C)C1)C(=O)OCCCCCCCCCCC