| SpectraBase Spectrum ID |
HxQIOmp2MFH |
| Name |
Ethyl 2,3,5,6-tetrafluoro-4-[(phenylmethylidene)amino]benzoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.072591248 u |
| Formula |
C16H11F4NO2 |
| InChI |
InChI=1S/C16H11F4NO2/c1-2-23-16(22)10-11(17)13(19)15(14(20)12(10)18)21-8-9-6-4-3-5-7-9/h3-8H,2H2,1H3/b21-8+ |
| InChIKey |
ZFQUODJZKZZARC-ODCIPOBUSA-N |
| Molecular Weight |
325.263 g/mol |
| SMILES |
C1(=C(C(=C(C(=C1\N=C\C1=CC=CC=C1)F)F)C(OCC)=O)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838482 |
![Ethyl 2,3,5,6-tetrafluoro-4-[(phenylmethylidene)amino]benzoate](/api/spectrum/HxQIOmp2MFH/structure.png?h=300&w=458 "Ethyl 2,3,5,6-tetrafluoro-4-[(phenylmethylidene)amino]benzoate")
