| SpectraBase Spectrum ID |
G4Zqdnoktzm |
| Name |
1-(2-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)15-7-9-27(10-8-15)14-16-5-3-4-6-18(16)25;/h3-13H,14H2,1-2H3;1H |
| InChIKey |
YNHSZAGZUNGCFK-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)Cc1c(cccc1)Cl)=O |
| SPLASH |
splash10-004i-1904000000-cdedcde35c6fe222fdfb |
| Source of Spectrum |
BJO-14-SM9-9b |
| Wiley ID |
1845736 |
