Myclobutanil-3-hydroxybutyl

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For Research Use Only | Not For Clinical Use
CATAPS116928939
CAS116928-93-9
Structure
Synonymsα-(4-Chlorophenyl)-α-(3-hydroxybutyl)-1H-1,2,4-triazole-1-propanenitrile,1H-1,2,4-Triazole-1-propanenitrile, α-(4-chlorophenyl)-α-(3-hydroxybutyl)-
IUPAC Name2-(4-chlorophenyl)-5-hydroxy-2-(1,2,4-triazol-1-ylmethyl)hexanenitrile
Molecular Weight304.7747
Molecular FormulaC15H17ClN4O
Canonical SMILESCC(O)CCC(Cn1cncn1)(C#N)c2ccc(Cl)cc2
InChIInChI=1S/C15H17ClN4O/c1-12(21)6-7-15(8-17,9-20-11-18-10-19-20)13-2-4-14(16)5-3-13/h2-5,10-12,21H,6-7,9H2,1H3
Accurate Mass304.1091
FormatNeat
Product TypeMetabolite
SubcategoryFungicides and metabolites
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