![10-Methoxy-7-benzo[a]phenalenone](/api/spectrum/Bpb2rs3Kgt3/structure.png?h=300&w=458 "10-Methoxy-7-benzo[a]phenalenone")
| SpectraBase Compound ID | 3quPJzm0h6Q |
|---|---|
| InChI | InChI=1S/C18H12O2/c1-20-12-8-9-14-16(10-12)13-6-2-4-11-5-3-7-15(17(11)13)18(14)19/h2-10H,1H3 |
| InChIKey | GXLVRCRVTHLSBI-UHFFFAOYSA-N |
| Mol Weight | 260.29 g/mol |
| Molecular Formula | C18H12O2 |
| Exact Mass | 260.08373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Bpb2rs3Kgt3 |
|---|---|
| Name | 10-Methoxy-7-benzo[A]phenalenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 260.083729624 u |
| Formula | C18H12O2 |
| InChI | InChI=1S/C18H12O2/c1-20-12-8-9-14-16(10-12)13-6-2-4-11-5-3-7-15(17(11)13)18(14)19/h2-10H,1H3 |
| InChIKey | GXLVRCRVTHLSBI-UHFFFAOYSA-N |
| SMILES | C1=2C3=C4C(C=CC=C4C(C2C=CC(=C1)OC)=O)=CC=C3 |