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4-Methyl-3-phenyl-sydnone

View entire compound with spectra: 6 NMR, and 3 MS (GC)

4-Methyl-3-phenyl-sydnone
SpectraBase Compound ID ue05vN8TAx
InChI InChI=1S/C9H8N2O2/c1-7-9(12)13-10-11(7)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey PQBFRUJESKYJDP-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C9H8N2O2
Exact Mass 176.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BITB4DmZMnE
Name 4-Methyl-3-phenyl-1,2,3-oxadiazol-3-ium-5-olate
Alternate Name(s) 4-Methyl-3-phenyl-5-oxadiazol-3-iumolate 4-Methyl-3-phenyl-oxadiazol-3-ium-5-olate 4-Methyl-3-phenylsydnone 4-Methyl-3-phenyloxadiazol-3-ium-5-olate
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Formula C9H8N2O2
InChI InChI=1S/C9H8N2O2/c1-7-9(12)13-10-11(7)8-5-3-2-4-6-8/h2-6H,1H3
InChIKey PQBFRUJESKYJDP-UHFFFAOYSA-N
Molecular Weight 176.175 g/mol
SMILES c1(on[n+](c1C)-c1ccccc1)[O-]
SPLASH splash10-00or-9600000000-31056bf83ea99d7d431e
Source of Spectrum AD-0-2055-0
Wiley ID 1172093