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Concept information

Preferred term

توتیلوم توتیل  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C18H24BrNO3S

inchi

  • InChI=1S/C11H17BrN.C7H8O3S/c1-4-13(2,3)9-10-7-5-6-8-11(10)12;1-6-2-4-7(5-3-6)11(8,9)10/h5-8H,4,9H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

inchikey

  • KVWNWTZZBKCOPM-UHFFFAOYSA-M

mass

  • 414.35700

monoisotopicmass

  • 413.06603

smiles

  • Cc1ccc(cc1)S([O-])(=O)=O.CC[N+](C)(C)Cc1ccccc1Br

subset

  • 3_STAR

synonym EXACT

  • N-(2-bromobenzyl)-N,N-dimethylethanaminium 4-methylbenzenesulfonate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:3173

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