Chem
J-GLOBAL ID：200907097698488500   Nikkaji number：J1.441.758C

(E)-1-(4-Methoxyphenyl)-3-[(S)-1,4-dioxaspiro[4.5]decane-2-yl]-2-propene-1-one

(E)-1-(4-メトキシフェニル)-3-[(S)-1,4-ジオキサスピロ[4.5]デカン-2-イル]-2-プロペン-1-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： C18H22O4
Molecular formula furigana： C18-H22-O4
Molecular weight： 302.370
InChI： InChI=1S/C18H22O4/c1-20-15-7-5-14(6-8-15)17(19)10-9-16-13-21-18(22-16)11-3-2-4-12-18/h5-10,16H,2-4,11-13H2,1H3/b10-9+/t16-/m0/s1
InChI key： MBVHEJIIMNYUHE-SCOAYWHSSA-N
SMILES： COc1ccc(cc1)C(=O)/C=C/[C@H]1COC2(CCCCC2)O1
Systematic name  (3)：
  • (E)-1-(4-メトキシフェニル)-3-[(S)-1,4-ジオキサスピロ[4.5]デカン-2-イル]-2-プロペン-1-オン
  • (2E)-3-[(2S)-1,4-ジオキサスピロ[4.5]デカン-2-イル]-1-(4-メトキシフェニル)プロパ-2-エン-1-オン
  • (2E)-3-[(2S)-1,4-dioxaspiro[4.5]decan-2-yl]-1-(4-methoxyphenyl)prop-2-en-1-one
Other name (1)：
  • (E)-1-(4-Methoxyphenyl)-3-[(S)-1,4-dioxaspiro[4.5]decane-2-yl]-2-propene-1-one
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