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(S)-(+)-1-cyclohexylethylamine, N-(2-methylpropionyl)-
SpectraBase Compound ID IpwkOIt7ef9
InChI InChI=1S/C12H23NO/c1-9(2)12(14)13-10(3)11-7-5-4-6-8-11/h9-11H,4-8H2,1-3H3,(H,13,14)
InChIKey BEDWFNLFXBQPMX-UHFFFAOYSA-N
Mol Weight 197.32 g/mol
Molecular Formula C12H23NO
Exact Mass 197.177964 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ABLhsVDO1zo
Name (S)-(+)-1-cyclohexylethylamine, N-(2-methylpropionyl)-
Comments Computed using HOSE algorithm
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Exact Mass 197.177964364 u
Formula C12H23NO
InChI InChI=1S/C12H23NO/c1-9(2)12(14)13-10(3)11-7-5-4-6-8-11/h9-11H,4-8H2,1-3H3,(H,13,14)
InChIKey BEDWFNLFXBQPMX-UHFFFAOYSA-N
Molecular Weight 197.322 g/mol
SMILES C1(C(NC(C(C)C)=O)C)CCCCC1