![5,6,11,12-Tetrahydrobenzo[C][1,6]benzodiazocine](/api/spectrum/4GHzu47OcZw/structure.png?h=300&w=458 "5,6,11,12-Tetrahydrobenzo[C][1,6]benzodiazocine")
| SpectraBase Compound ID | 8pXxh0tpQ7m |
|---|---|
| InChI | InChI=1S/C14H14N2/c1-2-6-12-10-16-14-8-4-3-7-13(14)15-9-11(12)5-1/h1-8,15-16H,9-10H2 |
| InChIKey | PPCRJSFDFXUADF-UHFFFAOYSA-N |
| Mol Weight | 210.28 g/mol |
| Molecular Formula | C14H14N2 |
| Exact Mass | 210.115698 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4GHzu47OcZw |
|---|---|
| Name | 5,6,11,12-Tetrahydrobenzo[C][1,6]benzodiazocine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.115698459 u |
| Formula | C14H14N2 |
| InChI | InChI=1S/C14H14N2/c1-2-6-12-10-16-14-8-4-3-7-13(14)15-9-11(12)5-1/h1-8,15-16H,9-10H2 |
| InChIKey | PPCRJSFDFXUADF-UHFFFAOYSA-N |
| Molecular Weight | 210.280 g/mol |
| SMILES | C=12NCC=3C(CNC2=CC=CC1)=CC=CC3 |