SpectraBase Compound ID | AtUgkM153YJ |
---|---|
InChI | InChI=1S/C12H10N6O2/c1-7-9(10(19)8-5-3-2-4-6-8)14-17-18(7)12-11(13)15-20-16-12/h2-6H,1H3,(H2,13,15) |
InChIKey | ICROFYVSDAJZRI-UHFFFAOYSA-N |
Mol Weight | 270.25 g/mol |
Molecular Formula | C12H10N6O2 |
Exact Mass | 270.086524 g/mol |
SpectraBase Spectrum ID | 7wkQxHYkCuH |
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Name | [1-(4-Aminofurazan-3-yl)-5-methyl-1H-[1,2,3]triazol-4-yl](phenyl)methanone |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 270.086523584 u |
Formula | C12H10N6O2 |
InChI | InChI=1S/C12H10N6O2/c1-7-9(10(19)8-5-3-2-4-6-8)14-17-18(7)12-11(13)15-20-16-12/h2-6H,1H3,(H2,13,15) |
InChIKey | ICROFYVSDAJZRI-UHFFFAOYSA-N |
SMILES | C1=CC=C(C=C1)C(C1=C(N(C=2C(=NON2)N)N=N1)C)=O |