| SpectraBase Spectrum ID |
40JdBh7lWOg |
| Name |
2-[6-Iodo-1-oxo-3-phenylisoquinolin-2(1H)-yl]-pyridine-2-oxide |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
440.002172665 u |
| Formula |
C20H13IN2O2 |
| InChI |
InChI=1S/C20H13IN2O2/c21-16-9-10-17-15(12-16)13-18(14-6-2-1-3-7-14)23(20(17)24)19-8-4-5-11-22(19)25/h1-13H |
| InChIKey |
PBNJQKMABNBHPD-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201712647 |
| Molecular Weight |
440.240 g/mol |
| Quality |
177 |
| Reported Formula |
C20H13IN2O2 |
| SMILES |
C1=CC2=C(C=C1I)C=C(N(C2=O)C=1[N+](=CC=CC1)[O-])C=1C=CC=CC1 |
| SPLASH |
splash10-003r-4903300000-df9066d216b427ec4cb9 |
| Source of Spectrum |
ACI-57-SM11-3ia (DOI: 10.1002/anie.201712647) |
| Wiley ID |
1891219 |
![2-[6-Iodo-1-oxo-3-phenylisoquinolin-2(1H)-yl] pyridine 1-oxide](/api/spectrum/40JdBh7lWOg/structure.png?h=300&w=458 "2-[6-Iodo-1-oxo-3-phenylisoquinolin-2(1H)-yl] pyridine 1-oxide")
