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Ethanone, 1-(3,5-dimethyl-1,2,4-triazol-1-yl)-
SpectraBase Compound ID EUkRY3exuCK
InChI InChI=1S/C6H9N3O/c1-4-7-5(2)9(8-4)6(3)10/h1-3H3
InChIKey SXMIZEBMZHNGMI-UHFFFAOYSA-N
Mol Weight 139.16 g/mol
Molecular Formula C6H9N3O
Exact Mass 139.074562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOGl30NRuPW
Name Ethanone, 1-(3,5-dimethyl-1,2,4-triazol-1-yl)-
Alternate Name(s) 1-(3,5-dimethyl-1,2,4-triazol-1-yl)ethanone 1-Acetyl-3,5-dimethyl-1H-1,2,4-triazole
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Formula C6H9N3O
InChI InChI=1S/C6H9N3O/c1-4-7-5(2)9(8-4)6(3)10/h1-3H3
InChIKey SXMIZEBMZHNGMI-UHFFFAOYSA-N
Molecular Weight 139.158 g/mol
SMILES CC([n]1c(nc(n1)C)C)=O
SPLASH splash10-052f-9000000000-72c2c438f93cb3ec558f
Source of Spectrum AD-0-2532-0
Wiley ID 1429154