| SpectraBase Spectrum ID |
6gyGYoAYYUt |
| Name |
1-(2,4,6-Trihydroxy-5-(carboxy)phenyl)-3-(3-hydroxy-4-methoxyphenyl)propanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.084517467 u |
| Formula |
C17H16O8 |
| InChI |
InChI=1S/C17H16O8/c1-25-13-5-3-8(6-10(13)19)2-4-9(18)14-11(20)7-12(21)15(16(14)22)17(23)24/h3,5-7,19-22H,2,4H2,1H3,(H,23,24) |
| InChIKey |
SMTLVNOHUDWEJF-UHFFFAOYSA-N |
| Molecular Weight |
348.307 g/mol |
| SMILES |
C=1(C(=C(C(=O)CCC=2C=C(O)C(=CC2)OC)C(=CC1O)O)O)C(=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.81631 |
