Chem
J-GLOBAL ID：200907035519275200   Nikkaji number：J360.170F

MBDB

MBDB
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： C12H17NO2
Molecular formula furigana： C12-H17-N-O2
Molecular weight： 207.273
InChI： InChI=1S/C12H17NO2/c1-3-10(13-2)6-9-4-5-11-12(7-9)15-8-14-11/h4-5,7,10,13H,3,6,8H2,1-2H3
InChI key： USWVWJSAJAEEHQ-UHFFFAOYSA-N
SMILES： CCC(Cc1ccc2OCOc2c1)NC
Systematic name  (14)：
  • N-メチル-1-(1,3-ベンゾジオキソール-5-イル)ブタン-2-アミン
  • 1-(1,3-ベンゾジオキソール-5-イル)-2-(メチルアミノ)ブタン
  • 2-(1,3-ベンゾジオキソール-5-イル)-1-エチル-N-メチルエタン-1-アミン
  • N-メチル-1-(1,3-ベンゾジオキソール-5-イル)-2-ブタンアミン
  • N-メチル-α-エチル-1,3-ベンゾジオキソール-5-エタンアミン
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Other name (10)：
  • N-Methyl-1-(1,3-benzodioxol-5-yl)-2-butanamine
  • MBDB
  • N-Methyl-α-ethyl-1,3-benzodioxole-5-ethanamine
  • α-Ethyl-N-methyl-1,3-benzodioxole-5-ethanamine
  • N-Methyl-1-[3,4-(methylenedioxy)phenyl]-2-butanamine
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CAS registry number： 135795-90-3
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