| SpectraBase Spectrum ID |
863rlcgelpl |
| Name |
2-[6-Trifluoromethyl-1-oxo-3-phenylisoquinolin-2(1H)-yl]-pyridine-2-oxide |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.092912154 u |
| Formula |
C21H13F3N2O2 |
| InChI |
InChI=1S/C21H13F3N2O2/c22-21(23,24)16-9-10-17-15(12-16)13-18(14-6-2-1-3-7-14)26(20(17)27)19-8-4-5-11-25(19)28/h1-13H |
| InChIKey |
SRSPOAUKZURSBM-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201712647 |
| Molecular Weight |
382.342 g/mol |
| Quality |
167 |
| Reported Formula |
C21H13F3N2O2 |
| SMILES |
C1=CC2=C(C=C1C(F)(F)F)C=C(N(C2=O)C=1[N+](=CC=CC1)[O-])C=1C=CC=CC1 |
| SPLASH |
splash10-003r-7927000000-b72bcf558fd18e8d4c59 |
| Source of Spectrum |
ACI-57-SM11-3ja (DOI: 10.1002/anie.201712647) |
| Wiley ID |
1891220 |
![2-[6-Trifluoromethyl-1-oxo-3-phenylisoquinolin-2(1H)-yl]-pyridine-2-oxide](/api/spectrum/863rlcgelpl/structure.png?h=300&w=458 "2-[6-Trifluoromethyl-1-oxo-3-phenylisoquinolin-2(1H)-yl]-pyridine-2-oxide")
