Chem
J-GLOBAL ID:201207071341945607
Nikkaji number:J3.071.097E
3-(2,2-Dimethylpropyl)-4-acetyl-3-cyclopentene-1,1-dicarboxylic acid dimethyl ester
3-(2,2-ジメチルプロピル)-4-アセチル-3-シクロペンテン-1,1-ジカルボン酸ジメチル
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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:
C16 H24 O5
Molecular formula furigana:
C16-H24-O5
Molecular weight:
296.363
InChI:
InChI=1S/C16H24O5/c1-10(17)12-9-16(13(18)20-5,14(19)21-6)8-11(12)7-15(2,3)4/h7-9H2,1-6H3
InChI key:
LFTODFYWORWHDA-UHFFFAOYSA-N
SMILES:
COC(=O)C1(CC(=C(C1)C(=O)C)CC(C)(C)C)C(=O)OC
Systematic name (3):
3-(2,2-ジメチルプロピル)-4-アセチル-3-シクロペンテン-1,1-ジカルボン酸ジメチル
1,1-ジメチル 3-アセチル-4-(2,2-ジメチルプロピル)シクロペンタ-3-エン-1,1-ジカルボキシラート
1,1-dimethyl 3-acetyl-4-(2,2-dimethylpropyl)cyclopent-3-ene-1,1-dicarboxylate
Other name (1):
3-(2,2-Dimethylpropyl)-4-acetyl-3-cyclopentene-1,1-dicarboxylic acid dimethyl ester
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