Chem
J-GLOBAL ID：200907021807826686   Nikkaji number：J1.913.712K

(2R,6S)-2β-(Acetoxymethyl)-3β,9β-dimethyl-8α-(2-butynyl)-1,7-dioxaspiro[5.5]undecane

(2R,6S)-2β-(アセトキシメチル)-3β,9β-ジメチル-8α-(2-ブチニル)-1,7-ジオキサスピロ[5.5]ウンデカン
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： C18H28O4
Molecular formula furigana： C18-H28-O4
Molecular weight： 308.418
InChI： InChI=1S/C18H28O4/c1-5-6-7-16-13(2)8-10-18(21-16)11-9-14(3)17(22-18)12-20-15(4)19/h13-14,16-17H,7-12H2,1-4H3/t13-,14-,16+,17-,18-/m0/s1
InChI key： UOBTZUDSFSGIKH-ABJHKEKUSA-N
SMILES： CC#CC[C@H]1O[C@@]2(CC[C@H](C)[C@H](COC(=O)C)O2)CC[C@@H]1C
Systematic name  (3)：
  • (2R,6S)-2β-(アセトキシメチル)-3β,9β-ジメチル-8α-(2-ブチニル)-1,7-ジオキサスピロ[5.5]ウンデカン
  • [(2R,3S,6S,8R,9S)-8-(ブタ-2-イン-1-イル)-3,9-ジメチル-1,7-ジオキサスピロ[5.5]ウンデカン-2-イル]メチル アセタート
  • [(2R,3S,6S,8R,9S)-8-(but-2-yn-1-yl)-3,9-dimethyl-1,7-dioxaspiro[5.5]undecan-2-yl]methyl acetate
Other name (1)：
  • (2R,6S)-2β-(Acetoxymethyl)-3β,9β-dimethyl-8α-(2-butynyl)-1,7-dioxaspiro[5.5]undecane
Thsaurus map：
Thesaurus Map

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