Chem
J-GLOBAL ID：200907001117445107   Nikkaji number：J1.729.976J

2,2,3aβ-Trimethyl-3a,4,8aβ,8bβ-tetrahydrofuro[2,3-e]-1,3-benzodioxole-6(7H)-one

2,2,3aβ-トリメチル-3a,4,8aβ,8bβ-テトラヒドロフロ[2,3-e]-1,3-ベンゾジオキソール-6(7H)-オン
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： C12H16O4
Molecular formula furigana： C12-H16-O4
Molecular weight： 224.256
InChI： InChI=1S/C12H16O4/c1-11(2)15-10-9-7(8(13)6-14-9)4-5-12(10,3)16-11/h4,9-10H,5-6H2,1-3H3/t9-,10-,12+/m0/s1
InChI key： PLPLMOWUCMPYNJ-JBLDHEPKSA-N
SMILES： CC1(C)O[C@H]2[C@H]3OCC(=O)C3=CC[C@@]2(C)O1
Systematic name  (3)：
  • 2,2,3aβ-トリメチル-3a,4,8aβ,8bβ-テトラヒドロフロ[2,3-e]-1,3-ベンゾジオキソール-6(7H)-オン
  • (1S,2S,6R)-4,4,6-トリメチル-3,5,12-トリオキサトリシクロ[7.3.0.02,6]ドデカ-8-エン-10-オン
  • (1S,2S,6R)-4,4,6-trimethyl-3,5,12-trioxatricyclo[7.3.0.02,6]dodec-8-en-10-one
Other name (1)：
  • 2,2,3aβ-Trimethyl-3a,4,8aβ,8bβ-tetrahydrofuro[2,3-e]-1,3-benzodioxole-6(7H)-one
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