| SpectraBase Spectrum ID |
E47paG51N88 |
| Name |
4'-Hydroxy-4-methoxy-2'-methylchalcone, trifluoroacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
364.092243448 u |
| Formula |
C19H15F3O4 |
| InChI |
InChI=1S/C19H15F3O4/c1-12-11-15(26-18(24)19(20,21)22)8-9-16(12)17(23)10-5-13-3-6-14(25-2)7-4-13/h3-11H,1-2H3/b10-5+ |
| InChIKey |
UARHMLRRYJKXDC-BJMVGYQFSA-N |
| Molecular Weight |
364.320 g/mol |
| SMILES |
C1(=CC=C(C=C1C)OC(C(F)(F)F)=O)C(\C=C\C1=CC=C(C=C1)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.845552 |
