Chem
J-GLOBAL ID：200907047701024911
Nikkaji number：J1.259.991I
2-Propargyl-2-(8,8-dimethoxy-2-octenyl)malonic acid dimethyl ester
2-プロパルギル-2-(8,8-ジメトキシ-2-オクテニル)マロン酸ジメチル
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
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
Molecular formula： C18H28O6
Molecular formula furigana： C18-H28-O6
Molecular weight： 340.416
InChI：
InChI=1S/C18H28O6/c1-6-13-18(16(19)23-4,17(20)24-5)14-11-9-7-8-10-12-15(21-2)22-3/h1,9,11,15H,7-8,10,12-14H2,2-5H3
InChI key：
KHCYFLFSYDWMOD-UHFFFAOYSA-N
SMILES：
COC(CCCCC=CCC(CC#C)(C(=O)OC)C(=O)OC)OC
Systematic name (3)：
- 2-プロパルギル-2-(8,8-ジメトキシ-2-オクテニル)マロン酸ジメチル
- 1,3-ジメチル 2-(8,8-ジメトキシオクタ-2-エン-1-イル)-2-(プロパ-2-イン-1-イル)プロパンジオアート
- 1,3-dimethyl 2-(8,8-dimethoxyoct-2-en-1-yl)-2-(prop-2-yn-1-yl)propanedioate
- 2-Propargyl-2-(8,8-dimethoxy-2-octenyl)malonic acid dimethyl ester
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