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5,5-DIMETHYL-4-HYDROXY-2-OXO-3-HEXENE
SpectraBase Compound ID 8IO4fHhAqda
InChI InChI=1S/C8H14O2/c1-6(9)5-7(10)8(2,3)4/h5,10H,1-4H3/b7-5-
InChIKey ADKXSDNPFKCVRC-ALCCZGGFSA-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 8xzKMWr3shH
Name Pivaloylacetone, enol form
Comments Structure changed after expert review
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Formula C8H14O2
InChI InChI=1S/C8H14O2/c1-6(9)5-7(10)8(2,3)4/h5,10H,1-4H3/b7-5-
InChIKey ADKXSDNPFKCVRC-ALCCZGGFSA-N
Molecular Weight 142.198 g/mol
SMILES O\C(C(C)(C)C)=C/C(=O)C
SPLASH splash10-000f-9000000000-fc0b4510dcace09bad91
Synonyms (3Z)-4-Hydroxy-5,5-dimethyl-3-hexen-2-one (Z)-4-hydroxy-5,5-dimethylhex-3-en-2-one
Wiley ID 1476905