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(1-HYDROXY-2-METHYLCYCLOHEXYL)-ACETONITRILE

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(1-HYDROXY-2-METHYLCYCLOHEXYL)-ACETONITRILE
SpectraBase Compound ID BjuvKuismxC
InChI InChI=1S/2C9H15NO/c2*1-8-4-2-3-5-9(8,11)6-7-10/h2*8,11H,2-6H2,1H3
InChIKey PNEZJRWTUXVSDZ-UHFFFAOYSA-N
Mol Weight 306.45 g/mol
Molecular Formula C18H30N2O2
Exact Mass 306.230728 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GiTd8DlF8uT
Name (1-HYDROXY-2-METHYLCYCLOHEXYL)-ACETONITRILE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H30N2O2
InChI InChI=1S/2C9H15NO/c2*1-8-4-2-3-5-9(8,11)6-7-10/h2*8,11H,2-6H2,1H3
InChIKey PNEZJRWTUXVSDZ-UHFFFAOYSA-N
Literature Reference Author P.KISANGA,D.M.LEOD,B.D.SA,J.VERKADE
Literature Reference Citation J.ORG.CHEM.,64,3090(1999)
Literature Reference DOI 10.1021/jo981858y
Molecular Weight 306.448 g/mol
Sample ID 59214
Solvent CDCl3