![4-Benzo[1,3]dioxo-5-ylpyridine](/api/spectrum/6hrKrSeQI3k/structure.png?h=300&w=458 "4-Benzo[1,3]dioxo-5-ylpyridine")
| SpectraBase Compound ID | 20Lx21yEFx4 |
|---|---|
| InChI | InChI=1S/C12H9NO2/c1-2-11-12(15-8-14-11)7-10(1)9-3-5-13-6-4-9/h1-7H,8H2 |
| InChIKey | ONMMXNUURRLBRR-UHFFFAOYSA-N |
| Mol Weight | 199.21 g/mol |
| Molecular Formula | C12H9NO2 |
| Exact Mass | 199.063329 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6hrKrSeQI3k |
|---|---|
| Name | 4-Benzo[1,3]dioxo-5-ylpyridine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.063328532 u |
| Formula | C12H9NO2 |
| InChI | InChI=1S/C12H9NO2/c1-2-11-12(15-8-14-11)7-10(1)9-3-5-13-6-4-9/h1-7H,8H2 |
| InChIKey | ONMMXNUURRLBRR-UHFFFAOYSA-N |
| Molecular Weight | 199.209 g/mol |
| SMILES | C=12C=C(C=3C=CN=CC3)C=CC1OCO2 |