Chem
J-GLOBAL ID：200907045546069552
Nikkaji number：J2.506.713D
3-Isobutyl-4-[(Z)-1-(bromomethyl)-1-hexenyl]-5-phenyl-2,5-dihydrofuran-2-one
3-イソブチル-4-[(Z)-1-(ブロモメチル)-1-ヘキセニル]-5-フェニル-2,5-ジヒドロフラン-2-オン
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： C21H27BrO2
Molecular formula furigana： C21-H27-BR-O2
Molecular weight： 391.349
InChI：
InChI=1S/C21H27BrO2/c1-4-5-7-12-17(14-22)19-18(13-15(2)3)21(23)24-20(19)16-10-8-6-9-11-16/h6,8-12,15,20H,4-5,7,13-14H2,1-3H3/b17-12+
InChI key：
FULFLRNNHMJQFV-SFQUDFHCSA-N
SMILES：
CCCC/C=C(\CBr)/C1=C(CC(C)C)C(=O)OC1c1ccccc1
Systematic name (3)：
- 3-イソブチル-4-[(Z)-1-(ブロモメチル)-1-ヘキセニル]-5-フェニル-2,5-ジヒドロフラン-2-オン
- 4-[(2Z)-1-ブロモヘプタ-2-エン-2-イル]-3-(2-メチルプロピル)-5-フェニル-2,5-ジヒドロフラン-2-オン
- 4-[(2Z)-1-bromohept-2-en-2-yl]-3-(2-methylpropyl)-5-phenyl-2,5-dihydrofuran-2-one
- 3-Isobutyl-4-[(Z)-1-(bromomethyl)-1-hexenyl]-5-phenyl-2,5-dihydrofuran-2-one
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