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L-Leucine, N-ethoxycarbonyl-N-methyl-, pentyl ester
SpectraBase Compound ID HnmlLiiNsj2
InChI InChI=1S/C15H29NO4/c1-6-8-9-10-20-14(17)13(11-12(3)4)16(5)15(18)19-7-2/h12-13H,6-11H2,1-5H3
InChIKey FXSMZWUYBOKLNT-UHFFFAOYSA-N
Mol Weight 287.4 g/mol
Molecular Formula C15H29NO4
Exact Mass 287.209658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DZ7VfjhBGh6
Name L-Leucine, N-ethoxycarbonyl-N-methyl-, pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 287.209658414 u
Formula C15H29NO4
InChI InChI=1S/C15H29NO4/c1-6-8-9-10-20-14(17)13(11-12(3)4)16(5)15(18)19-7-2/h12-13H,6-11H2,1-5H3
InChIKey FXSMZWUYBOKLNT-UHFFFAOYSA-N
SMILES CCOC(N(C(CC(C)C)C(OCCCCC)=O)C)=O