Chem
J-GLOBAL ID：200907072026420297   Nikkaji number：J1.170.517K

[3-Methyl-5-(2,6,6-trimethyl-4β-hydroxy-1-cyclohexenyl)-2-penten-4-ynyl]triphenylphosphonium

[3-メチル-5-(2,6,6-トリメチル-4β-ヒドロキシ-1-シクロヘキセニル)-2-ペンテン-4-イニル]トリフェニルホスホニウム
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： C33H36O[P+]
Molecular formula furigana： C33-H36-O-P
Molecular weight： 479.623
InChI： InChI=1S/C33H36OP/c1-26(20-21-32-27(2)24-28(34)25-33(32,3)4)22-23-35(29-14-8-5-9-15-29,30-16-10-6-11-17-30)31-18-12-7-13-19-31/h5-19,22,28,34H,23-25H2,1-4H3/q+1/t28-/m1/s1
InChI key： PAZJYGWOIBJTHS-MUUNZHRXSA-N
SMILES： CC(=CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)C#CC1=C(C)C[C@@H](O)CC1(C)C
Systematic name  (3)：
  • [3-メチル-5-(2,6,6-トリメチル-4β-ヒドロキシ-1-シクロヘキセニル)-2-ペンテン-4-イニル]トリフェニルホスホニウム
  • {5-[(4R)-4-ヒドロキシ-2,6,6-トリメチルシクロヘキサ-1-エン-1-イル]-3-メチルペンタ-2-エン-4-イン-1-イル}トリフェニルホスファニウム
  • {5-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-3-methylpent-2-en-4-yn-1-yl}triphenylphosphanium
Other name (1)：
  • [3-Methyl-5-(2,6,6-trimethyl-4β-hydroxy-1-cyclohexenyl)-2-penten-4-ynyl]triphenylphosphonium
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