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1-(2'-Aminophenyl)-4-(3",4"-dimethoxyphenyl)-5-oxo-(1,2,3)-triazole
SpectraBase Compound ID E48Da8I0Mhf
InChI InChI=1S/C16H16N4O3/c1-22-13-8-7-10(9-14(13)23-2)15-16(21)20(19-18-15)12-6-4-3-5-11(12)17/h3-9,19H,17H2,1-2H3
InChIKey HUCFAQCVWMBNMW-UHFFFAOYSA-N
Mol Weight 312.33 g/mol
Molecular Formula C16H16N4O3
Exact Mass 312.12224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ltekpql0MNn
Name 1-(2'-Aminophenyl)-4-(3",4"-dimethoxyphenyl)-5-oxo-(1,2,3)-triazole
Alternate Name(s) 3-(2-aminophenyl)-5-(3,4-dimethoxyphenyl)-2H-1,2,3-triazol-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C16H16N4O3
InChI InChI=1S/C16H16N4O3/c1-22-13-8-7-10(9-14(13)23-2)15-16(21)20(19-18-15)12-6-4-3-5-11(12)17/h3-9,19H,17H2,1-2H3
InChIKey HUCFAQCVWMBNMW-UHFFFAOYSA-N
Molecular Weight 312.329 g/mol
SMILES N1N=C(C(N1c1c(cccc1)N)=O)c1cc(OC)c(cc1)OC
SPLASH splash10-0002-9000000000-a83d3fb93b8bdec8a261
Source of Spectrum AF-48-2939-31
Wiley ID 1693868