| SpectraBase Spectrum ID |
JpmzGmFcxDe |
| Name |
5-Acetyl-4-(5-chloro-1-oxido-3-pyridin-1-iumyl)-1H-pyrrole-2-carboxylic acid methyl ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H11ClN2O4 |
| InChI |
InChI=1S/C13H11ClN2O4/c1-7(17)12-10(4-11(15-12)13(18)20-2)8-3-9(14)6-16(19)5-8/h3-6,15H,1-2H3 |
| InChIKey |
NRPDMCPRHFWFBF-UHFFFAOYSA-N |
| Molecular Weight |
294.694 g/mol |
| SMILES |
[nH]1c(c(cc1C(=O)OC)-c1c[n+](cc(c1)Cl)[O-])C(=O)C |
| SPLASH |
splash10-0006-7590000000-33c5ba76a3e0f90451cb |
| Source of Spectrum |
E1-46-407-19 |
| Synonyms |
5-Acetyl-4-(5-chloro-1-oxido-pyridin-1-ium-3-yl)-1H-pyrrole-2-carboxylic acid methyl ester
Methyl 4-(5-chloranyl-1-oxidanidyl-pyridin-1-ium-3-yl)-5-ethanoyl-1H-pyrrole-2-carboxylate
Methyl 5-acetyl-4-(5-chloro-1-oxido-pyridin-1-ium-3-yl)-1H-pyrrole-2-carboxylate |
| Wiley ID |
1554241 |
