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3-[(1S,3S)-3-methylcyclohexyl]pentane-2,4-dione

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3-[(1S,3S)-3-methylcyclohexyl]pentane-2,4-dione
SpectraBase Compound ID IIzDnfYoLZ0
InChI InChI=1S/C12H20O2/c1-8-5-4-6-11(7-8)12(9(2)13)10(3)14/h8,11-12H,4-7H2,1-3H3/t8-,11-/m0/s1
InChIKey DHJXQOMUSLISNJ-KWQFWETISA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3Wjytn8tO1I
Name 3-[(1S,3S)-3-methylcyclohexyl]pentane-2,4-dione
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-8-5-4-6-11(7-8)12(9(2)13)10(3)14/h8,11-12H,4-7H2,1-3H3/t8-,11-/m0/s1
InChIKey DHJXQOMUSLISNJ-KWQFWETISA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 196.290 g/mol
Source File Reference MHKO17475