| SpectraBase Spectrum ID |
E6MGIM0lYKx |
| Name |
o-(Trifluoromethyl)carbanilic acid, 6-bromo-4-chloro-o-tolyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
406.953553753 u |
| Formula |
C15H10BrClF3NO2 |
| InChI |
InChI=1S/C15H10BrClF3NO2/c1-8-6-9(17)7-11(16)13(8)23-14(22)21-12-5-3-2-4-10(12)15(18,19)20/h2-7H,1H3,(H,21,22) |
| InChIKey |
JNKYZALUKXGGKH-UHFFFAOYSA-N |
| Molecular Weight |
408.602 g/mol |
| SMILES |
C(F)(F)(F)C=1C(=CC=CC1)NC(OC=1C(=CC(=CC1Br)Cl)C)=O |
