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L-Alanine, N-cyclobutylcarbonyl-, heptyl ester
SpectraBase Compound ID G7uUP845pfF
InChI InChI=1S/C15H27NO3/c1-3-4-5-6-7-11-19-15(18)12(2)16-14(17)13-9-8-10-13/h12-13H,3-11H2,1-2H3,(H,16,17)
InChIKey KNOFPIOOQKVCFZ-UHFFFAOYSA-N
Mol Weight 269.38 g/mol
Molecular Formula C15H27NO3
Exact Mass 269.199094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CPrQuwE3AZY
Name L-Alanine, N-cyclobutylcarbonyl-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 269.199093730 u
Formula C15H27NO3
InChI InChI=1S/C15H27NO3/c1-3-4-5-6-7-11-19-15(18)12(2)16-14(17)13-9-8-10-13/h12-13H,3-11H2,1-2H3,(H,16,17)
InChIKey KNOFPIOOQKVCFZ-UHFFFAOYSA-N
SMILES C1C(CC1)C(NC(C(OCCCCCCC)=O)C)=O