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(E)-2-(3-Hydroxy-3-methylbut-1-enyl)-5-methylcyclohexa-2,5-diene-1,4-dione
SpectraBase Compound ID 81VVmGFoM8g
InChI InChI=1S/C12H14O3/c1-8-6-11(14)9(7-10(8)13)4-5-12(2,3)15/h4-7,15H,1-3H3/b5-4+
InChIKey ASXUQJURKGGNOX-SNAWJCMRSA-N
Mol Weight 206.24 g/mol
Molecular Formula C12H14O3
Exact Mass 206.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnTNKZPsHBX
Name (E)-2-(3-Hydroxy-3-methylbut-1-enyl)-5-methylcyclohexa-2,5-diene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3
InChI InChI=1S/C12H14O3/c1-8-6-11(14)9(7-10(8)13)4-5-12(2,3)15/h4-7,15H,1-3H3/b5-4+
InChIKey ASXUQJURKGGNOX-SNAWJCMRSA-N
Literature Reference DOI 10.1021/ol901004e
Molecular Weight 206.241 g/mol
SMILES OC(\C=C\C1=CC(=O)C(=CC1=O)C)(C)C
SPLASH splash10-000i-3900000000-9c434f3f7b0db4d57938
Source of Spectrum A1-11-2988/SMS6-2
Synonyms (E)-2-(3-hydroxy-3-methylbut-1-en-1-yl)-5-methylcyclohexa-2,5-diene-1,4-dione 2-[(E)-3-hydroxy-3-methylbut-1-enyl]-5-methylcyclohexa-2,5-diene-1,4-dione 2-[(E)-3-hydroxy-3-methyl-but-1-enyl]-5-methyl-1,4-benzoquinone 2-Methyl-5-[(E)-3-methyl-3-oxidanyl-but-1-enyl]cyclohexa-2,5-diene-1,4-dione
Wiley ID 1756908