| SpectraBase Compound ID | E2iTlAq1hHi |
|---|---|
| InChI | InChI=1S/C20H16N2O4/c21-17-11-5-3-9-15(17)19(23)25-13-7-1-2-8-14-26-20(24)16-10-4-6-12-18(16)22/h3-6,9-12H,13-14,21-22H2 |
| InChIKey | PCIUFFRNQYULCP-UHFFFAOYSA-N |
| Mol Weight | 348.36 g/mol |
| Molecular Formula | C20H16N2O4 |
| Exact Mass | 348.111007 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8dr9cEYBOOA |
|---|---|
| Name | Hexa-2,4-diyn-1,6-diyl dianthranilate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.111006999 u |
| Formula | C20H16N2O4 |
| InChI | InChI=1S/C20H16N2O4/c21-17-11-5-3-9-15(17)19(23)25-13-7-1-2-8-14-26-20(24)16-10-4-6-12-18(16)22/h3-6,9-12H,13-14,21-22H2 |
| InChIKey | PCIUFFRNQYULCP-UHFFFAOYSA-N |
| Molecular Weight | 348.358 g/mol |
| SMILES | C=1(C(=O)OCC#CC#CCOC(C=2C(N)=CC=CC2)=O)C(N)=CC=CC1 |