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5,5-DIMETHYL-3-(1-NITROETHYL)-CYClOHEXANONE;DIASTEREOMER-#1
SpectraBase Compound ID 8cHgDoPI8A9
InChI InChI=1S/C10H17NO3/c1-7(11(13)14)8-4-9(12)6-10(2,3)5-8/h7-8H,4-6H2,1-3H3
InChIKey QTCXBDJOXMEEED-UHFFFAOYSA-N
Mol Weight 199.25 g/mol
Molecular Formula C10H17NO3
Exact Mass 199.120843 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 55KrFrt7cjh
Name 5,5-DIMETHYL-3-(1-NITROETHYL)-CYClOHEXANONE;DIASTEREOMER-#1
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H17NO3
InChI InChI=1S/C10H17NO3/c1-7(11(13)14)8-4-9(12)6-10(2,3)5-8/h7-8H,4-6H2,1-3H3
InChIKey QTCXBDJOXMEEED-UHFFFAOYSA-N
Literature Reference Author K.E.BAILEY,B.R.DAVIS
Literature Reference Citation AUSTR.J.CHEM.,48,1827(1995)
Literature Reference DOI 10.1071/ch9951827
Molecular Weight 199.250 g/mol
Solvent CDCl3
Source File Reference UWCP281