| SpectraBase Spectrum ID |
YKflFlxyep |
| Name |
Isophthalic acid, diamide N,N'-di(2-fluorophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
352.102334023 u |
| Formula |
C20H14F2N2O2 |
| InChI |
InChI=1S/C20H14F2N2O2/c21-15-8-1-3-10-17(15)23-19(25)13-6-5-7-14(12-13)20(26)24-18-11-4-2-9-16(18)22/h1-12H,(H,23,25)(H,24,26) |
| InChIKey |
NGMBMIKWVLIQJO-UHFFFAOYSA-N |
| Molecular Weight |
352.341 g/mol |
| SMILES |
C1=CC(=C(C=C1)NC(C1=CC(=CC=C1)C(NC1=CC=CC=C1F)=O)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969129 |
