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1-(2-oxido-4-pyrrol-1-yl-1,2,5-oxadiazol-2-ium-3-yl)ethanone
SpectraBase Compound ID 2NJRyTJPNaX
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
Mol Weight 193.16 g/mol
Molecular Formula C8H7N3O3
Exact Mass 193.048741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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