| SpectraBase Spectrum ID |
CN8pEUF8rkZ |
| Name |
Benzoic acid, 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-, ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.027784642 u |
| Formula |
C16H11ClF3NO5 |
| InChI |
InChI=1S/C16H11ClF3NO5/c1-2-25-15(22)11-8-10(4-5-13(11)21(23)24)26-14-6-3-9(7-12(14)17)16(18,19)20/h3-8H,2H2,1H3 |
| InChIKey |
ZXYLZOBDCIFSPF-UHFFFAOYSA-N |
| Molecular Weight |
389.714 g/mol |
| SMILES |
C1(=CC=C(C=C1C(OCC)=O)OC1=C(C=C(C=C1)C(F)(F)F)Cl)N(=O)=O |
![Benzoic acid, 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-, ethyl ester](/api/spectrum/CN8pEUF8rkZ/structure.png?h=300&w=458 "Benzoic acid, 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-, ethyl ester")
