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1-Octanamine, N,N-diethyl-
SpectraBase Compound ID SNYbHQMeRz
InChI InChI=1S/C12H27N/c1-4-7-8-9-10-11-12-13(5-2)6-3/h4-12H2,1-3H3
InChIKey BVUGARXRRGZONH-UHFFFAOYSA-N
Mol Weight 185.35 g/mol
Molecular Formula C12H27N
Exact Mass 185.21435 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DGsf3GKZrcS
Name 1-Octanamine, N,N-diethyl-
Comments Computed using HOSE algorithm
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Exact Mass 185.214349873 u
Formula C12H27N
InChI InChI=1S/C12H27N/c1-4-7-8-9-10-11-12-13(5-2)6-3/h4-12H2,1-3H3
InChIKey BVUGARXRRGZONH-UHFFFAOYSA-N
Molecular Weight 185.355 g/mol
SMILES CCCCCCCCN(CC)CC