Chem
J-GLOBAL ID：200907093510291164   Nikkaji number：J2.764.939D

2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetate

4,5,5-トリメチル-2-オキソ-3-シクロペンテン-1-酢酸
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C10H14O3
Molecular formula furigana： C10-H14-O3
Molecular weight： 182.219
InChI： InChI=1S/C10H14O3/c1-6-4-8(11)7(5-9(12)13)10(6,2)3/h4,7H,5H2,1-3H3,(H,12,13)
InChI key： UJJNLVMCZZZXFW-UHFFFAOYSA-N
SMILES： CC1=CC(=O)C(CC(=O)O)C1(C)C
Systematic name  (3)：
  • 4,5,5-トリメチル-2-オキソ-3-シクロペンテン-1-酢酸
  • 2-(2,2,3-トリメチル-5-オキソシクロペンタ-3-エン-1-イル)酢酸
  • 2-(2,2,3-trimethyl-5-oxocyclopent-3-en-1-yl)acetic acid
Other name (3)：
  • 4,5,5-Trimethyl-2-oxo-3-cyclopentene-1-acetic acid
  • 2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetate
  • 2-Oxo-delta3-4,5,5-trimethylcyclopentenylacetic acid
CAS registry number： 1130-49-0
KEGG COMPOUND： C07159
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