| SpectraBase Compound ID | 26fdQIREdWy |
|---|---|
| InChI | InChI=1S/C18H16O5/c1-20-12-6-4-11(5-7-12)17-18(22-3)16(19)14-9-8-13(21-2)10-15(14)23-17/h4-10H,1-3H3 |
| InChIKey | GJEOSFLNWGXQQO-UHFFFAOYSA-N |
| Mol Weight | 312.32 g/mol |
| Molecular Formula | C18H16O5 |
| Exact Mass | 312.099774 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1DysbORAnJR |
|---|---|
| Name | 3,4',7-Trimethoxy flavone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.099773610 u |
| Formula | C18H16O5 |
| InChI | InChI=1S/C18H16O5/c1-20-12-6-4-11(5-7-12)17-18(22-3)16(19)14-9-8-13(21-2)10-15(14)23-17/h4-10H,1-3H3 |
| InChIKey | GJEOSFLNWGXQQO-UHFFFAOYSA-N |
| SMILES | C1=C(C=C2C(=C1)C(C(=C(O2)C1=CC=C(C=C1)OC)OC)=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944404 |