| SpectraBase Compound ID | 1okihsrG2Yc |
|---|---|
| InChI | InChI=1S/C20H14O3/c1-22-18-9-5-4-8-16(18)19-12-17(21)15-11-10-13-6-2-3-7-14(13)20(15)23-19/h2-12H,1H3 |
| InChIKey | ZPCVGYBSUXVZLD-UHFFFAOYSA-N |
| Mol Weight | 302.33 g/mol |
| Molecular Formula | C20H14O3 |
| Exact Mass | 302.094294 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7jkl2wBX2tN |
|---|---|
| Name | 2'-Methoxy-7,8-benzoflavone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.094294308 u |
| Formula | C20H14O3 |
| InChI | InChI=1S/C20H14O3/c1-22-18-9-5-4-8-16(18)19-12-17(21)15-11-10-13-6-2-3-7-14(13)20(15)23-19/h2-12H,1H3 |
| InChIKey | ZPCVGYBSUXVZLD-UHFFFAOYSA-N |
| SMILES | C1(=O)C=C(C2=C(OC)C=CC=C2)OC=2C1=CC=C1C=CC=CC21 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.865015 |