![4-[5-NITRO-BENZOTRIAZOL-1-YL]-5-CARBOXAMIDO-1,2,3-TRIAZOLE](/api/spectrum/D2PleVuleVk/structure.png?h=300&w=458 "4-[5-NITRO-BENZOTRIAZOL-1-YL]-5-CARBOXAMIDO-1,2,3-TRIAZOLE")
| SpectraBase Compound ID | J5R4R7KDdg7 |
|---|---|
| InChI | InChI=1S/C9H6N8O3/c10-8(18)7-9(13-14-12-7)16-6-2-1-4(17(19)20)3-5(6)11-15-16/h1-3H,(H2,10,18)(H,12,13,14) |
| InChIKey | FPNPQYRXXUEHIR-UHFFFAOYSA-N |
| Mol Weight | 274.2 g/mol |
| Molecular Formula | C9H6N8O3 |
| Exact Mass | 274.056286 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D2PleVuleVk |
|---|---|
| Name | 4-[5-NITRO-BENZOTRIAZOL-1-YL]-5-CARBOXAMIDO-1,2,3-TRIAZOLE |
| Compound Number | 1F |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI | InChI=1S/C9H6N8O3/c10-8(18)7-9(13-14-12-7)16-6-2-1-4(17(19)20)3-5(6)11-15-16/h1-3H,(H2,10,18)(H,12,13,14) |
| InChIKey | FPNPQYRXXUEHIR-UHFFFAOYSA-N |
| Literature Reference | G.BIAGI,I.GIORGI,O.LIVI,V.SCARTONI,S.VELO,P.L.BARILI J.HETCYCL.CHEM.,33,1847(1996) |
| Solvent | Dimethyl sulfoxide-d6 |