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5-Aminovaleric acid, N-(N-propyloxycarbonyl)-, methyl ester
SpectraBase Compound ID 5kIHCHLYSH4
InChI InChI=1S/C10H19NO4/c1-3-8-15-10(13)11-7-5-4-6-9(12)14-2/h3-8H2,1-2H3,(H,11,13)
InChIKey MGOJTRJHJXPGNW-UHFFFAOYSA-N
Mol Weight 217.26 g/mol
Molecular Formula C10H19NO4
Exact Mass 217.131408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F839sSFnsyG
Name 5-Aminovaleric acid, N-(N-propyloxycarbonyl)-, methyl ester
Comments Computed using HOSE algorithm
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Exact Mass 217.131408092 u
Formula C10H19NO4
InChI InChI=1S/C10H19NO4/c1-3-8-15-10(13)11-7-5-4-6-9(12)14-2/h3-8H2,1-2H3,(H,11,13)
InChIKey MGOJTRJHJXPGNW-UHFFFAOYSA-N
Molecular Weight 217.265 g/mol
SMILES C(NC(OCCC)=O)CCCC(OC)=O