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L-Norvaline, N-benzyloxycarbonyl-, ethyl ester
SpectraBase Compound ID G0wdW65FO1W
InChI InChI=1S/C15H21NO4/c1-3-8-13(14(17)19-4-2)16-15(18)20-11-12-9-6-5-7-10-12/h5-7,9-10,13H,3-4,8,11H2,1-2H3,(H,16,18)
InChIKey JEHNPBPAAWWZKA-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C15H21NO4
Exact Mass 279.147058 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FmdMkVJiXaP
Name L-Norvaline, N-benzyloxycarbonyl-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 279.147058156 u
Formula C15H21NO4
InChI InChI=1S/C15H21NO4/c1-3-8-13(14(17)19-4-2)16-15(18)20-11-12-9-6-5-7-10-12/h5-7,9-10,13H,3-4,8,11H2,1-2H3,(H,16,18)
InChIKey JEHNPBPAAWWZKA-UHFFFAOYSA-N
Molecular Weight 279.336 g/mol
SMILES C1=CC=CC(=C1)COC(NC(CCC)C(OCC)=O)=O