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2-tert-Butyl-4,4-dimethyl-6-oxidanyl-cyclohexa-2,5-dien-1-one
SpectraBase Compound ID 2cfRi5zwYXH
InChI InChI=1S/C12H18O2/c1-11(2,3)8-6-12(4,5)7-9(13)10(8)14/h6-7,13H,1-5H3
InChIKey PAOZYHARMJADOX-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID c2sWtHEqOE
Name 2-tert-Butyl-4,4-dimethyl-6-oxidanyl-cyclohexa-2,5-dien-1-one
CAS Registry Number 122800-85-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-11(2,3)8-6-12(4,5)7-9(13)10(8)14/h6-7,13H,1-5H3
InChIKey PAOZYHARMJADOX-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES OC=1C(C(=CC(C1)(C)C)C(C)(C)C)=O
SPLASH splash10-0f79-0900000000-90ada980f301a3afd1d8
Source of Spectrum J-54-4865-7
Synonyms 2-tert-Butyl-6-hydroxy-4,4-dimethyl-1-cyclohexa-2,5-dienone 2-tert-Butyl-6-hydroxy-4,4-dimethyl-cyclohexa-2,5-dien-1-one
Wiley ID 1191151