| SpectraBase Spectrum ID |
KdhRaCzrCzZ |
| Name |
1H-Phenalen-1-one, 9-(3,4-dimethoxyphenyl)-4-hydroxy-2-methoxy- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
362.115423675 u |
| Formula |
C22H18O5 |
| InChI |
InChI=1S/C22H18O5/c1-25-17-9-6-13(10-18(17)26-2)14-7-4-12-5-8-16(23)15-11-19(27-3)22(24)21(14)20(12)15/h4-11,23H,1-3H3 |
| InChIKey |
AZDXQTSQRKQRME-UHFFFAOYSA-N |
| Molecular Weight |
362.381 g/mol |
| SMILES |
C=12C3=C(C(O)=CC=C3C=CC1C=1C=C(OC)C(=CC1)OC)C=C(C2=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944524 |
