Chem
J-GLOBAL ID：200907028812518064   Nikkaji number：J221.541A

Butyrylthiocholine

ブチリルチオコリン
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： C9H20[N+]OS
Molecular formula furigana： C9-H20-N-O-S
Molecular weight： 190.320
InChI： InChI=1S/C9H20NOS/c1-5-6-9(11)12-8-7-10(2,3)4/h5-8H2,1-4H3/q+1
InChI key： AWBGQVBMGBZGLS-UHFFFAOYSA-N
SMILES： CCCC(=O)SCC[N+](C)(C)C
Systematic name  (7)：
  • 2-ブチリルチオ-N,N,N-トリメチルエタンアミニウム
  • S-ブチリルチオコリン
  • N,N,N-トリメチル-2-[(1-オキソブチル)チオ]エタンアミニウム
  • 2-(ブチリルチオ)エチルトリメチルアンモニウム
  • N,N,N-トリメチル-2-(ブチリルチオ)エタンアミニウム
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Other name (7)：
  • 2-Butyrylthio-N,N,N-trimethylethanaminium
  • S-Butyrylthiocholine
  • N,N,N-Trimethyl-2-[(1-oxobutyl)thio]ethanaminium
  • ブチリルチオコリン
  • 2-(Butyrylthio)ethyltrimethylammonium
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CAS registry number： 4555-00-4
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