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3-chloro-2-hydroxy-5,6-dimethylcyclohepta-2,4,6-trien-1-one
SpectraBase Compound ID GG4bGzUDwoT
InChI InChI=1S/C9H9ClO2/c1-5-3-7(10)9(12)8(11)4-6(5)2/h3-4H,1-2H3,(H,11,12)
InChIKey NHBVSGNALXFSKL-UHFFFAOYSA-N
Mol Weight 184.62 g/mol
Molecular Formula C9H9ClO2
Exact Mass 184.029107 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GCMmUGzR4qB
Name 3-chloro-2-hydroxy-5,6-dimethylcyclohepta-2,4,6-trien-1-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9ClO2
InChI InChI=1S/C9H9ClO2/c1-5-3-7(10)9(12)8(11)4-6(5)2/h3-4H,1-2H3,(H,11,12)
InChIKey NHBVSGNALXFSKL-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 184.622 g/mol
Source File Reference MHKO21224