| SpectraBase Compound ID | J3HOGdj44QX |
|---|---|
| InChI | InChI=1S/C10H9N3O3/c11-13-12-9(14)7-5-6-3-1-2-4-8(6)16-10(7)15/h1-5,13H,11H2,(H,12,14) |
| InChIKey | DYNAERMIUOXNGC-UHFFFAOYSA-N |
| Mol Weight | 219.2 g/mol |
| Molecular Formula | C10H9N3O3 |
| Exact Mass | 219.064391 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3mpthgF6hNd |
|---|---|
| Name | 2H-Benzopyrane-3-carbotriazanyde, 2-oxo- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.064391159 u |
| Formula | C10H9N3O3 |
| InChI | InChI=1S/C10H9N3O3/c11-13-12-9(14)7-5-6-3-1-2-4-8(6)16-10(7)15/h1-5,13H,11H2,(H,12,14) |
| InChIKey | DYNAERMIUOXNGC-UHFFFAOYSA-N |
| Molecular Weight | 219.200 g/mol |
| SMILES | C12=CC=CC=C2C=C(C(O1)=O)C(NNN)=O |