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L-Isoleucyl-L-leucine, N-ethoxycarbonyl-, ethyl ester
SpectraBase Compound ID JpbUtiMJ6m7
InChI InChI=1S/C17H32N2O5/c1-7-12(6)14(19-17(22)24-9-3)15(20)18-13(10-11(4)5)16(21)23-8-2/h11-14H,7-10H2,1-6H3,(H,18,20)(H,19,22)
InChIKey YEVKJQJKLWUDTF-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C17H32N2O5
Exact Mass 344.231122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4F4xivCVaRt
Name L-Isoleucyl-L-leucine, N-ethoxycarbonyl-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 344.231122133 u
Formula C17H32N2O5
InChI InChI=1S/C17H32N2O5/c1-7-12(6)14(19-17(22)24-9-3)15(20)18-13(10-11(4)5)16(21)23-8-2/h11-14H,7-10H2,1-6H3,(H,18,20)(H,19,22)
InChIKey YEVKJQJKLWUDTF-UHFFFAOYSA-N
Molecular Weight 344.452 g/mol
SMILES CCOC(=O)NC(C(CC)C)C(NC(C(OCC)=O)CC(C)C)=O