| SpectraBase Spectrum ID |
12BcguaMHAF |
| Name |
2'-Hydroxy-6'-methoxychalcone, trifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.076593384 u |
| Formula |
C18H13F3O4 |
| InChI |
InChI=1S/C18H13F3O4/c1-24-14-8-5-9-15(25-17(23)18(19,20)21)16(14)13(22)11-10-12-6-3-2-4-7-12/h2-11H,1H3/b11-10+ |
| InChIKey |
CDMQTPITEFQEGZ-ZHACJKMWSA-N |
| Molecular Weight |
350.293 g/mol |
| SMILES |
C1(=C(C=CC=C1OC(C(F)(F)F)=O)OC)C(\C=C\C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.862323 |
