SpectraBase Spectrum ID |
J56WbmhQL78 |
Name |
1-(2-oxido-4-pyrrol-1-yl-1,2,5-oxadiazol-2-ium-3-yl)ethanone |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C8H7N3O3 |
InChI |
InChI=1S/C8H7N3O3/c1-6(12)7-8(9-14-11(7)13)10-4-2-3-5-10/h2-5H,1H3 |
InChIKey |
KXVVYPVNISGJBT-UHFFFAOYSA-N |
Instrument Name |
Finnigan MAT INCOS-50 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/jhet.1940 |
Molecular Weight |
193.162 g/mol |
SMILES |
c1[n](ccc1)-c1c([n+](on1)[O-])C(=O)C |
SPLASH |
splash10-0006-9800000000-07c21588107f0836cc5a |
Source of Spectrum |
Y-53-108-16a |
Thin-Layer Chromatography |
Rf = 0.41 (CHCl3/EtOAc, 8:1) |
Wiley ID |
1877546 |