| SpectraBase Spectrum ID |
6RYZWQAegK9 |
| Name |
1-(3-Chlorobenzyl)-4-(6,7-dimethoxy-2-oxo-2H-chromen-3-ylcarbamoyl)pyridinium bromide |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H20BrClN2O5 |
| InChI |
InChI=1S/C24H19ClN2O5.BrH/c1-30-21-12-17-11-19(24(29)32-20(17)13-22(21)31-2)26-23(28)16-6-8-27(9-7-16)14-15-4-3-5-18(25)10-15;/h3-13H,14H2,1-2H3;1H |
| InChIKey |
MCXKYNBHQVYGIM-UHFFFAOYSA-N |
| Instrument Name |
Finnigan POLARIS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.14.231 |
| Molecular Weight |
531.790 g/mol |
| Reported Formula |
C24H20BrClN2O5 |
| SMILES |
[Br-].N(C=1C(Oc2c(cc(c(c2)OC)OC)C1)=O)C(c1cc[n+](cc1)Cc1cc(ccc1)Cl)=O |
| SPLASH |
splash10-004i-1809000000-92267de87a236ac2697a |
| Source of Spectrum |
BJO-14-SM9-9c |
| Wiley ID |
1845737 |
