Chem
J-GLOBAL ID:200907027528902230   Nikkaji number:J2.316.536H

(4R,5R,6R)-2,2,5,6-Tetramethyl-4-(benzyloxymethyl)-1,3-dioxane-5-propiononitrile

(4R,5R,6R)-2,2,5,6-テトラメチル-4-(ベンジルオキシメチル)-1,3-ジオキサン-5-プロピオノニトリル
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: C19H27NO3
Molecular formula furigana: C19-H27-N-O3
Molecular weight: 317.429
InChI: InChI=1S/C19H27NO3/c1-15-19(4,11-8-12-20)17(23-18(2,3)22-15)14-21-13-16-9-6-5-7-10-16/h5-7,9-10,15,17H,8,11,13-14H2,1-4H3/t15-,17+,19-/m1/s1
InChI key: XKTRHJYDFVGVOD-HHXXYDBFSA-N
SMILES: C[C@H]1OC(C)(C)O[C@@H](COCc2ccccc2)[C@]1(C)CCC#N
Systematic name  (3):
  • (4R,5R,6R)-2,2,5,6-テトラメチル-4-(ベンジルオキシメチル)-1,3-ジオキサン-5-プロピオノニトリル
  • 3-[(4R,5R,6R)-4-[(ベンジルオキシ)メチル]-2,2,5,6-テトラメチル-1,3-ジオキサン-5-イル]プロパンニトリル
  • 3-[(4R,5R,6R)-4-[(benzyloxy)methyl]-2,2,5,6-tetramethyl-1,3-dioxan-5-yl]propanenitrile
Other name (1):
  • (4R,5R,6R)-2,2,5,6-Tetramethyl-4-(benzyloxymethyl)-1,3-dioxane-5-propiononitrile
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