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val-val, N,N'-Dimethyl-N-(N-propyloxycarbonyl)-, methyl ester (isomer 1)
SpectraBase Compound ID 2MggvcWIZYE
InChI InChI=1S/C17H32N2O5/c1-9-10-24-17(22)19(7)13(11(2)3)15(20)18(6)14(12(4)5)16(21)23-8/h11-14H,9-10H2,1-8H3
InChIKey SXGDEORCIZKKNQ-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 AXGSEpbe6it
Name val-val, N,N'-Dimethyl-N-(N-propyloxycarbonyl)-, methyl ester (isomer 1)
Comments Computed using HOSE algorithm
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Exact Mass 344.231122133 u
Formula C17H32N2O5
InChI InChI=1S/C17H32N2O5/c1-9-10-24-17(22)19(7)13(11(2)3)15(20)18(6)14(12(4)5)16(21)23-8/h11-14H,9-10H2,1-8H3
InChIKey SXGDEORCIZKKNQ-UHFFFAOYSA-N
Molecular Weight 344.452 g/mol
SMILES CC(C(C(N(C(C(C)C)C(OC)=O)C)=O)N(C)C(OCCC)=O)C