| SpectraBase Spectrum ID |
Bj6dWWtpWTw |
| Name |
4-[4-(Trifluoromethyl)phenyl]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
307.082013117 u |
| Formula |
C16H12F3NO2 |
| InChI |
InChI=1S/C16H12F3NO2/c17-16(18,19)10-3-5-11(6-4-10)20-14(21)12-8-1-2-9(7-8)13(12)15(20)22/h1-6,8-9,12-13H,7H2 |
| InChIKey |
BSEVBIJSEUMTNE-UHFFFAOYSA-N |
| Molecular Weight |
307.272 g/mol |
| SMILES |
C=1C=C(N2C(C3C4C=CC(C3C2=O)C4)=O)C=CC1C(F)(F)F |
![4-[4-(Trifluoromethyl)phenyl]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione](/api/spectrum/Bj6dWWtpWTw/structure.png?h=300&w=458 "4-[4-(Trifluoromethyl)phenyl]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione")
