| SpectraBase Spectrum ID |
HCqMUJxWfCq |
| Name |
2-Aminoanthraquinone, N-pentafluoropropionyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.042433934 u |
| Formula |
C17H8F5NO3 |
| InChI |
InChI=1S/C17H8F5NO3/c18-16(19,17(20,21)22)15(26)23-8-5-6-11-12(7-8)14(25)10-4-2-1-3-9(10)13(11)24/h1-7H,(H,23,26) |
| InChIKey |
KIRDEPJMDDPVJJ-UHFFFAOYSA-N |
| Molecular Weight |
369.247 g/mol |
| SMILES |
C1(C2=C(C(C3=C1C=CC(=C3)NC(C(C(F)(F)F)(F)F)=O)=O)C=CC=C2)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942566 |
