| SpectraBase Spectrum ID |
4kdEb3ZO0Je |
| Name |
1H-Phenalen-1-one, 7-(3,4-dimethoxyphenyl)-8-methoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.120509056 u |
| Formula |
C22H18O4 |
| InChI |
InChI=1S/C22H18O4/c1-24-18-10-8-14(11-19(18)25-2)22-15-6-4-5-13-7-9-17(23)16(21(13)15)12-20(22)26-3/h4-12H,1-3H3 |
| InChIKey |
ZFXKUMHDSQLKAM-UHFFFAOYSA-N |
| Molecular Weight |
346.382 g/mol |
| SMILES |
C1=2C=3C(=CC=CC3C=CC1=O)C(=C(C2)OC)C=1C=C(OC)C(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965039 |
