| SpectraBase Spectrum ID |
F3xRAUlReLn |
| Name |
2,4-Dimethoxyaniline, N,N-bis(pentafluoropropionyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
445.037189400 u |
| Formula |
C14H9F10NO4 |
| InChI |
InChI=1S/C14H9F10NO4/c1-28-6-3-4-7(8(5-6)29-2)25(9(26)11(15,16)13(19,20)21)10(27)12(17,18)14(22,23)24/h3-5H,1-2H3 |
| InChIKey |
AKLLHUAMFYUDHJ-UHFFFAOYSA-N |
| Molecular Weight |
445.213 g/mol |
| SMILES |
C1(OC)=C(C=CC(=C1)OC)N(C(=O)C(F)(C(F)(F)F)F)C(C(F)(C(F)(F)F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.815536 |
