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dl-Alanine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, heptyl ester
SpectraBase Compound ID CqlGsGtN5qO
InChI InChI=1S/C22H41NO4/c1-7-8-9-10-11-14-26-21(24)18(5)23(6)22(25)27-20-15-17(4)12-13-19(20)16(2)3/h16-20H,7-15H2,1-6H3
InChIKey ZYJKVKNGJCTJAZ-UHFFFAOYSA-N
Mol Weight 383.6 g/mol
Molecular Formula C22H41NO4
Exact Mass 383.303559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4kylBC1ZYxb
Name dl-Alanine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 383.303558800 u
Formula C22H41NO4
InChI InChI=1S/C22H41NO4/c1-7-8-9-10-11-14-26-21(24)18(5)23(6)22(25)27-20-15-17(4)12-13-19(20)16(2)3/h16-20H,7-15H2,1-6H3
InChIKey ZYJKVKNGJCTJAZ-UHFFFAOYSA-N
Molecular Weight 383.573 g/mol
SMILES CC(N(C)C(=O)OC1C(C(C)C)CCC(C)C1)C(=O)OCCCCCCC