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L-Leucine, N-(2-methoxyethoxycarbonyl)-, butyl ester
SpectraBase Compound ID 8hTZzITiXsI
InChI InChI=1S/C14H27NO5/c1-5-6-7-19-13(16)12(10-11(2)3)15-14(17)20-9-8-18-4/h11-12H,5-10H2,1-4H3,(H,15,17)
InChIKey VWWKUCSCFBYWQK-UHFFFAOYSA-N
Mol Weight 289.37 g/mol
Molecular Formula C14H27NO5
Exact Mass 289.188923 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1B7sVXpAiHz
Name L-Leucine, N-(2-methoxyethoxycarbonyl)-, butyl ester
Comments Computed using HOSE algorithm
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Exact Mass 289.188922968 u
Formula C14H27NO5
InChI InChI=1S/C14H27NO5/c1-5-6-7-19-13(16)12(10-11(2)3)15-14(17)20-9-8-18-4/h11-12H,5-10H2,1-4H3,(H,15,17)
InChIKey VWWKUCSCFBYWQK-UHFFFAOYSA-N
SMILES COCCOC(NC(CC(C)C)C(OCCCC)=O)=O