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5-METHYL-3-HEXAN-2-ONE,MINOR-COMPONENT
SpectraBase Compound ID DhmuEpl21ZQ
InChI InChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h4-6H,1-3H3/b5-4+
InChIKey IYMKNYVCXUEFJE-SNAWJCMRSA-N
Mol Weight 112.17 g/mol
Molecular Formula C7H12O
Exact Mass 112.088815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KD4omx78H9P
Name 5-METHYL-3-HEXAN-2-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O
InChI InChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h4-6H,1-3H3/b5-4+
InChIKey IYMKNYVCXUEFJE-SNAWJCMRSA-N
Literature Reference Author R.F.CHILDS,M.MAHENDRAN,C.BLACKBURN,G.ANTONIADIS
Literature Reference Citation CAN.J.CHEM.,66,1355(1988)
Literature Reference DOI 10.1139/v88-219
Molecular Weight 112.172 g/mol
Solvent FSO3H:SO2ClF
Source File Reference UWCS6910