![4-(2-Pyridinyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione](/api/spectrum/8VYnLvmRvCb/structure.png?h=300&w=458 "4-(2-Pyridinyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione")
| SpectraBase Compound ID | DZOqlpv5h08 |
|---|---|
| InChI | InChI=1S/C14H12N2O2/c17-13-11-8-4-5-9(7-8)12(11)14(18)16(13)10-3-1-2-6-15-10/h1-6,8-9,11-12H,7H2 |
| InChIKey | VOMLWUQRCXRNBP-UHFFFAOYSA-N |
| Mol Weight | 240.26 g/mol |
| Molecular Formula | C14H12N2O2 |
| Exact Mass | 240.089878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8VYnLvmRvCb |
|---|---|
| Name | 4-(2-Pyridinyl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.089877632 u |
| Formula | C14H12N2O2 |
| InChI | InChI=1S/C14H12N2O2/c17-13-11-8-4-5-9(7-8)12(11)14(18)16(13)10-3-1-2-6-15-10/h1-6,8-9,11-12H,7H2 |
| InChIKey | VOMLWUQRCXRNBP-UHFFFAOYSA-N |
| Molecular Weight | 240.262 g/mol |
| SMILES | C=1C=CC(N2C(C3C4C=CC(C3C2=O)C4)=O)=NC1 |