| SpectraBase Spectrum ID |
6HbnKD04z8C |
| Name |
1-(Dimethylamino)-4-(perfluoropropyl)anthraquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
419.075625769 u |
| Formula |
C19H12F7NO2 |
| InChI |
InChI=1S/C19H12F7NO2/c1-27(2)12-8-7-11(17(20,21)18(22,23)19(24,25)26)13-14(12)16(29)10-6-4-3-5-9(10)15(13)28/h3-8H,1-2H3 |
| InChIKey |
NONCASXGNJKXCT-UHFFFAOYSA-N |
| Molecular Weight |
419.299 g/mol |
| SMILES |
C(C(C1=C2C(C(=O)C3=C(C2=O)C=CC=C3)=C(C=C1)N(C)C)(F)F)(C(F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.812208 |
