| SpectraBase Spectrum ID |
52Sr4wbcaiB |
| Name |
(E)-1-(3,4-Dihydroxy-2,6-dimethoxyphenyl)-3-phenylprop-2-en-1-one, 2ac derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.120902977 u |
| Formula |
C21H20O7 |
| InChI |
InChI=1S/C21H20O7/c1-13(22)27-18-12-17(25-3)19(21(26-4)20(18)28-14(2)23)16(24)11-10-15-8-6-5-7-9-15/h5-12H,1-4H3/b11-10+ |
| InChIKey |
UMJWYJNCIILNDD-ZHACJKMWSA-N |
| Molecular Weight |
384.384 g/mol |
| SMILES |
C(\C=C\C1=CC=CC=C1)(=O)C1=C(C(=C(C=C1OC)OC(=O)C)OC(=O)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932131 |
