| SpectraBase Spectrum ID |
Kvo7D34JMho |
| Name |
Propanoic acid, pentafluoro-, 2-[2-[(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]ethyl]phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.042274781 u |
| Formula |
C14H9F10NO3 |
| InChI |
InChI=1S/C14H9F10NO3/c15-11(16,13(19,20)21)9(26)25-6-5-7-3-1-2-4-8(7)28-10(27)12(17,18)14(22,23)24/h1-4H,5-6H2,(H,25,26) |
| InChIKey |
DECFLQYBQRQVDA-UHFFFAOYSA-N |
| Molecular Weight |
429.214 g/mol |
| SMILES |
C(F)(F)(F)C(F)(F)C(=O)NCCC1=CC=CC=C1OC(C(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839053 |
![Propanoic acid, pentafluoro-, 2-[2-[(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]ethyl]phenyl ester](/api/spectrum/Kvo7D34JMho/structure.png?h=300&w=458 "Propanoic acid, pentafluoro-, 2-[2-[(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]ethyl]phenyl ester")
