![Ethanone, 1-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]-](/api/spectrum/7Hj9HshN5vW/structure.png?h=300&w=458 "Ethanone, 1-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]-")
| SpectraBase Compound ID | DNyMtDA83Rh |
|---|---|
| InChI | InChI=1S/C7H8N6O2/c1-3-5(4(2)14)9-12-13(3)7-6(8)10-15-11-7/h1-2H3,(H2,8,10) |
| InChIKey | INMLIYBPSFHPNL-UHFFFAOYSA-N |
| Mol Weight | 208.18 g/mol |
| Molecular Formula | C7H8N6O2 |
| Exact Mass | 208.070874 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7Hj9HshN5vW |
|---|---|
| Name | Ethanone, 1-[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-methyl-1H-1,2,3-triazol-4-yl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 208.070873520 u |
| Formula | C7H8N6O2 |
| InChI | InChI=1S/C7H8N6O2/c1-3-5(4(2)14)9-12-13(3)7-6(8)10-15-11-7/h1-2H3,(H2,8,10) |
| InChIKey | INMLIYBPSFHPNL-UHFFFAOYSA-N |
| Molecular Weight | 208.181 g/mol |
| SMILES | C1(=NON=C1N)N1C(C)=C(C(C)=O)N=N1 |