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3-METHYL-3-(1-NITROETHYL)-CYClOHEXANONE;DIASTEREOMER-#1
SpectraBase Compound ID CIwaKtJ29WX
InChI InChI=1S/C9H15NO3/c1-7(10(12)13)9(2)5-3-4-8(11)6-9/h7H,3-6H2,1-2H3
InChIKey IOYMOEYVAPADGJ-UHFFFAOYSA-N
Mol Weight 185.22 g/mol
Molecular Formula C9H15NO3
Exact Mass 185.105193 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1DoiMFFjsiA
Name 3-METHYL-3-(1-NITROETHYL)-CYClOHEXANONE;DIASTEREOMER-#1
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H15NO3
InChI InChI=1S/C9H15NO3/c1-7(10(12)13)9(2)5-3-4-8(11)6-9/h7H,3-6H2,1-2H3
InChIKey IOYMOEYVAPADGJ-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 185.223 g/mol
Solvent CDCl3
Source File Reference UWCP279