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1-(3,5-dichloro-1H-1,2,4-triazol-1-yl)-3,3-dimethylbutan-2-one
SpectraBase Compound ID 7hSuIocNkHf
InChI InChI=1S/C8H11Cl2N3O/c1-8(2,3)5(14)4-13-7(10)11-6(9)12-13/h4H2,1-3H3
InChIKey KOAUJFIJMUDAEJ-UHFFFAOYSA-N
Mol Weight 236.1 g/mol
Molecular Formula C8H11Cl2N3O
Exact Mass 235.027917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ClBlSMnRW5r
Name 1-(3,5-dichloro-1H-1,2,4-triazol-1-yl)-3,3-dimethylbutan-2-one
Alternate Name(s) 2-Butanone, 1-(3,5-dichloro-1H-1,2,4-triazol-1-yl)-3,3-dimethyl- 1-(3,5-dichloro-1,2,4-triazol-1-yl)-3,3-dimethyl-2-butanone 1-(3,5-dichloro-1,2,4-triazol-1-yl)-3,3-dimethylbutan-2-one 1-[3,5-bis(chloranyl)-1,2,4-triazol-1-yl]-3,3-dimethyl-butan-2-one
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Formula C8H11Cl2N3O
InChI InChI=1S/C8H11Cl2N3O/c1-8(2,3)5(14)4-13-7(10)11-6(9)12-13/h4H2,1-3H3
InChIKey KOAUJFIJMUDAEJ-UHFFFAOYSA-N
Molecular Weight 236.102 g/mol
SMILES CC(C(C[n]1c(nc(n1)Cl)Cl)=O)(C)C
SPLASH splash10-0a4i-9000000000-53822bc11554b2596778
Source of Spectrum IY-2-4703-7
Wiley ID 1655020