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4-Dichloromethyl-4-methyl-2,5-cyclohexadien-1-one

View entire compound with spectra: 17 NMR, 1 UV-Vis, and 3 MS (GC)

4-Dichloromethyl-4-methyl-2,5-cyclohexadien-1-one
SpectraBase Compound ID KiTUnqJkM0j
InChI InChI=1S/C8H8Cl2O/c1-8(7(9)10)4-2-6(11)3-5-8/h2-5,7H,1H3
InChIKey MJRRCEHODULPAV-UHFFFAOYSA-N
Mol Weight 191.06 g/mol
Molecular Formula C8H8Cl2O
Exact Mass 189.99522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JOfgKTnToI6
Name 4-DICHLOROMETHYL-4-METHYLCYCLOHEXA-2,5-DIENONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H8Cl2O
InChI InChI=1S/C8H8Cl2O/c1-8(7(9)10)4-2-6(11)3-5-8/h2-5,7H,1H3
InChIKey MJRRCEHODULPAV-UHFFFAOYSA-N
Literature Reference Author R.HOLLENSTEIN,W.VONPHILIPSBORN
Literature Reference Citation HELV.CHIM.ACTA,55,2030(1972)
Literature Reference DOI 10.1002/hlca.19720550622
Molecular Weight 191.057 g/mol
Solvent CDCl3
Source File Reference UNIW11980