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CHEBI:109402 - 2-[(1R,3S)-3-(7-bromo-2-methyl-1H-indol-3-yl)-2,2-dimethylcyclopropyl]acetonitrile

ChEBI IDCHEBI:109402
ChEBI Name2-[(1R,3S)-3-(7-bromo-2-methyl-1H-indol-3-yl)-2,2-dimethylcyclopropyl]acetonitrile
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DownloadsMolfile
FormulaC16H17BrN2
Net Charge0
Average Mass317.230
Monoisotopic Mass316.05751
SMILESCc1nc2c(Br)cccc2c1[C@H]1[C@@H](CC#N)C1(C)C
InChIInChI=1S/C16H17BrN2/c1-9-13(14-11(7-8-18)16(14,2)3)10-5-4-6-12(17)15(10)19-9/h4-6,11,14,19H,7H2,1-3H3/t11-,14-/m1/s1
InChIKeyXBXMATSTHLYKNO-BXUZGUMPSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[(1R,3S)-3-(7-bromo-2-methyl-1H-indol-3-yl)-2,2-dimethylcyclopropyl]acetonitrile (CHEBI:109402) is a indoles (CHEBI:24828)
Manual XrefsDatabases
LSM-20800LINCS