| SpectraBase Compound ID | 1fvXhK55eOT |
|---|---|
| InChI | InChI=1S/C15H12N2O2/c1-19-9-2-4-13-11(8-9)10-6-7-16-12-3-5-14(18)17(13)15(10)12/h2,4,6-8H,3,5H2,1H3 |
| InChIKey | STZUJCKEHJWUNP-UHFFFAOYSA-N |
| Mol Weight | 252.27 g/mol |
| Molecular Formula | C15H12N2O2 |
| Exact Mass | 252.089878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Y4ocEBO4On |
|---|---|
| Name | 4,5-Dihydro-10-methoxycanthin-6-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 252.089877632 u |
| Formula | C15H12N2O2 |
| InChI | InChI=1S/C15H12N2O2/c1-19-9-2-4-13-11(8-9)10-6-7-16-12-3-5-14(18)17(13)15(10)12/h2,4,6-8H,3,5H2,1H3 |
| InChIKey | STZUJCKEHJWUNP-UHFFFAOYSA-N |
| Molecular Weight | 252.273 g/mol |
| SMILES | C=12N3C4=C(C2=CC(=CC1)OC)C=CN=C4CCC3=O |