| SpectraBase Spectrum ID |
6Hr35Ast6EV |
| Name |
5-Bromo-2-hydroxy-3-(trifluoromethoxy)benzaldehyde, methyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
297.945241539 u |
| Formula |
C9H6BrF3O3 |
| InChI |
InChI=1S/C9H6BrF3O3/c1-15-8-5(4-14)2-6(10)3-7(8)16-9(11,12)13/h2-4H,1H3 |
| InChIKey |
OUAMAMSZFYYEJN-UHFFFAOYSA-N |
| Molecular Weight |
299.043 g/mol |
| SMILES |
C1(Br)=CC(=C(OC)C(C=O)=C1)OC(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.843736 |
