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1,3-Cyclohexanedione, 5,5-dimethyl-

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1,3-Cyclohexanedione, 5,5-dimethyl-
SpectraBase Compound ID FaTKif5V5Da
InChI InChI=1S/2C8H12O2/c2*1-8(2)4-6(9)3-7(10)5-8/h3-5H2,1-2H3;3,9H,4-5H2,1-2H3
InChIKey PGNKRIIOHRHONH-UHFFFAOYSA-N
Mol Weight 140.18 g/mol
Molecular Formula C8H12O2
Exact Mass 140.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ATtdv81shPU
Name 5,5-DIMETHYL-1,3-CYCLOHEXANEDIONE
Source of Sample Eastman Organic Chemicals, Rochester, New York
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O2
InChI InChI=1S/2C8H12O2/c2*1-8(2)4-6(9)3-7(10)5-8/h3-5H2,1-2H3;3,9H,4-5H2,1-2H3
InChIKey PGNKRIIOHRHONH-UHFFFAOYSA-N
Melting Point 146-148C
Molecular Weight 140.18
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 1,3-CYCLOHEXANEDIONE, 5,5-DIMETHYL-,