Chem
J-GLOBAL ID:200907044662186276   Nikkaji number:J1.138.125A

(4S)-2,2,5α-Trimethyl-4β-[(1R,2Z)-1,3-dimethyl-4-iodo-2-butenyl]-1,3-dioxane

(4S)-2,2,5α-トリメチル-4β-[(1R,2Z)-1,3-ジメチル-4-ヨード-2-ブテニル]-1,3-ジオキサン
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: C13H23IO2
Molecular formula furigana: C13-H23-I-O2
Molecular weight: 338.229
InChI: InChI=1S/C13H23IO2/c1-9(7-14)6-10(2)12-11(3)8-15-13(4,5)16-12/h6,10-12H,7-8H2,1-5H3/b9-6-/t10-,11-,12+/m1/s1
InChI key: AUBFDOCXCYFDEB-ZAGSSPRFSA-N
SMILES: C[C@H](/C=C(/C)\CI)[C@@H]1OC(C)(C)OC[C@H]1C
Systematic name  (3):
  • (4S)-2,2,5α-トリメチル-4β-[(1R,2Z)-1,3-ジメチル-4-ヨード-2-ブテニル]-1,3-ジオキサン
  • (4S,5R)-4-[(2R,3Z)-5-ヨード-4-メチルペンタ-3-エン-2-イル]-2,2,5-トリメチル-1,3-ジオキサン
  • (4S,5R)-4-[(2R,3Z)-5-iodo-4-methylpent-3-en-2-yl]-2,2,5-trimethyl-1,3-dioxane
Other name (1):
  • (4S)-2,2,5α-Trimethyl-4β-[(1R,2Z)-1,3-dimethyl-4-iodo-2-butenyl]-1,3-dioxane
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