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3-Hydroxy-4,4-dimethyl-1-cyclohexanone
SpectraBase Compound ID 3X4IchGEZth
InChI InChI=1S/C8H14O2/c1-8(2)4-3-6(9)5-7(8)10/h7,10H,3-5H2,1-2H3
InChIKey ANGDHMYJDGPYCB-UHFFFAOYSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7l4w7B9xgTv
Name 3-Hydroxy-4,4-dimethyl-1-cyclohexanone
Comments Less than 3 mono-isotopic peaks
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Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-8(2)4-3-6(9)5-7(8)10/h7,10H,3-5H2,1-2H3
InChIKey ANGDHMYJDGPYCB-UHFFFAOYSA-N
Molecular Weight 142.198 g/mol
SMILES OC1C(CCC(=O)C1)(C)C
SPLASH splash10-00dl-0900000000-a32f0de5cb42dfcd750c
Source of Spectrum F-47-7780-7
Synonyms 3-Hydroxy-4,4-dimethyl-cyclohexanone 3-Hydroxy-4,4-dimethylcyclohexanone 3-Hydroxy-4,4-dimethylcyclohexan-1-one 4,4-Dimethyl-3-oxidanyl-cyclohexan-1-one
Wiley ID 1141254