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(3-Oxo-1-propyl-butyl)-carbamic acid tert-butyl ester
SpectraBase Compound ID K4x4p6Z04T7
InChI InChI=1S/C12H23NO3/c1-6-7-10(8-9(2)14)13-11(15)16-12(3,4)5/h10H,6-8H2,1-5H3,(H,13,15)
InChIKey WSTRMSWKBJIEHL-UHFFFAOYSA-N
Mol Weight 229.32 g/mol
Molecular Formula C12H23NO3
Exact Mass 229.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Y1Otg2myOI
Name (3-oxo-1-Propyl-butyl)-carbamic acid tert-butyl ester
Comments Computed using HOSE algorithm
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Exact Mass 229.167793602 u
Formula C12H23NO3
InChI InChI=1S/C12H23NO3/c1-6-7-10(8-9(2)14)13-11(15)16-12(3,4)5/h10H,6-8H2,1-5H3,(H,13,15)
InChIKey WSTRMSWKBJIEHL-UHFFFAOYSA-N
Molecular Weight 229.320 g/mol
SMILES CCCC(CC(=O)C)NC(OC(C)(C)C)=O