Chem
J-GLOBAL ID：200907003439502133   Nikkaji number：J2.447.889K

1-[(1E,2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-2,4,6,8-nonatetraene-1-ylidene]-3,8-dimethyl-5-isopropylazulene

1-[(1E,2E,4E,6E,8E)-3,7-ジメチル-9-(2,6,6-トリメチル-1-シクロヘキセニル)-2,4,6,8-ノナテトラエン-1-イリデン]-3,8-ジメチル-5-イソプロピルアズレン
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： C35H44
Molecular formula furigana： C35-H44
Molecular weight： 464.737
InChI： InChI=1S/C35H44/c1-24(2)30-19-17-28(6)34-31(22-29(7)32(34)23-30)18-15-25(3)12-10-13-26(4)16-20-33-27(5)14-11-21-35(33,8)9/h10,12-13,15-20,22,24H,11,14,21H2,1-9H3/b12-10+,20-16+,25-15+,26-13+,31-18+
InChI key： VBTOSXTVJVMAPJ-UOQRREAWSA-N
SMILES： CC(C)C1=C=C2C(=C(C)C=C1)/C(=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)CCCC1(C)C)/C=C2C
Systematic name  (3)：
  • 1-[(1E,2E,4E,6E,8E)-3,7-ジメチル-9-(2,6,6-トリメチル-1-シクロヘキセニル)-2,4,6,8-ノナテトラエン-1-イリデン]-3,8-ジメチル-5-イソプロピルアズレン
  • (1E)-1-[(2E,4E,6E,8E)-3,7-ジメチル-9-(2,6,6-トリメチルシクロヘキサ-1-エン-1-イル)ノナ-2,4,6,8-テトラエン-1-イリデン]-3,8-ジメチル-5-(プロパン-2-イル)-1H-アズレン
  • (1E)-1-[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-ylidene]-3,8-dimethyl-5-(propan-2-yl)-1H-azulene
Other name (1)：
  • 1-[(1E,2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-2,4,6,8-nonatetraene-1-ylidene]-3,8-dimethyl-5-isopropylazulene
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