Chem
J-GLOBAL ID:200907025148149855   Nikkaji number:J2.509.176K

2,2-Dimethyl-7α,8β-bis(1-methoxy-1-methylethoxy)-8,8aβ-dihydro-4H-1,3-benzodioxin-6(7H)-one

2,2-ジメチル-7α,8β-ビス(1-メトキシ-1-メチルエトキシ)-8,8aβ-ジヒドロ-4H-1,3-ベンゾジオキシン-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: C18H30O7
Molecular formula furigana: C18-H30-O7
Molecular weight: 358.431
InChI: InChI=1S/C18H30O7/c1-16(2,20-7)24-14-12(19)9-11-10-22-18(5,6)23-13(11)15(14)25-17(3,4)21-8/h9,13-15H,10H2,1-8H3/t13-,14+,15+/m1/s1
InChI key: SRFZYVBWMVELQI-ILXRZTDVSA-N
SMILES: COC(C)(C)O[C@@H]1[C@@H](OC(C)(C)OC)C(=O)C=C2COC(C)(C)O[C@@H]12
Systematic name  (3):
  • 2,2-ジメチル-7α,8β-ビス(1-メトキシ-1-メチルエトキシ)-8,8aβ-ジヒドロ-4H-1,3-ベンゾジオキシン-6(7H)-オン
  • (7R,8S,8aR)-7,8-ビス[(2-メトキシプロパン-2-イル)オキシ]-2,2-ジメチル-2,4,6,7,8,8a-ヘキサヒドロ-1,3-ベンゾジオキシン-6-オン
  • (7R,8S,8aR)-7,8-bis[(2-methoxypropan-2-yl)oxy]-2,2-dimethyl-2,4,6,7,8,8a-hexahydro-1,3-benzodioxin-6-one
Other name (1):
  • 2,2-Dimethyl-7α,8β-bis(1-methoxy-1-methylethoxy)-8,8aβ-dihydro-4H-1,3-benzodioxin-6(7H)-one
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