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1-Aminocyclopentanecarboxylic acid, N-((1R)-(-)-menthyloxycarbonyl)-, heptyl ester
SpectraBase Compound ID 3j4Uic7yps7
InChI InChI=1S/C24H43NO4/c1-5-6-7-8-11-16-28-22(26)24(14-9-10-15-24)25-23(27)29-21-17-19(4)12-13-20(21)18(2)3/h18-21H,5-17H2,1-4H3,(H,25,27)
InChIKey IPZGFGKOVXXNBE-UHFFFAOYSA-N
Mol Weight 409.6 g/mol
Molecular Formula C24H43NO4
Exact Mass 409.319209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AoAk2ok1C3M
Name 1-Aminocyclopentanecarboxylic acid, N-((1R)-(-)-menthyloxycarbonyl)-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 409.319208865 u
Formula C24H43NO4
InChI InChI=1S/C24H43NO4/c1-5-6-7-8-11-16-28-22(26)24(14-9-10-15-24)25-23(27)29-21-17-19(4)12-13-20(21)18(2)3/h18-21H,5-17H2,1-4H3,(H,25,27)
InChIKey IPZGFGKOVXXNBE-UHFFFAOYSA-N
Molecular Weight 409.611 g/mol
SMILES C1CC(C(OCCCCCCC)=O)(NC(=O)OC2C(C(C)C)CCC(C)C2)CC1