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3-(4'-Hydroxyphenyl)-5-methylpyrazol-4-one - 1,2-dioxide
SpectraBase Compound ID 6DqkeWHF3Y9
InChI InChI=1S/C10H8N2O4/c1-6-10(14)9(12(16)11(6)15)7-2-4-8(13)5-3-7/h2-5,13H,1H3
InChIKey ZDMRUGVWKDGGAN-UHFFFAOYSA-N
Mol Weight 220.18 g/mol
Molecular Formula C10H8N2O4
Exact Mass 220.048407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7RRmgbjuFja
Name 3-(4'-Hydroxyphenyl)-5-methylpyrazol-4-one - 1,2-dioxide
Alternate Name(s) 3-(4-hydroxyphenyl)-5-methyl-4H-pyrazol-4-one 1,2-dioxide
Comments Less than 3 mono-isotopic peaks
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Formula C10H8N2O4
InChI InChI=1S/C10H8N2O4/c1-6-10(14)9(12(16)11(6)15)7-2-4-8(13)5-3-7/h2-5,13H,1H3
InChIKey ZDMRUGVWKDGGAN-UHFFFAOYSA-N
Molecular Weight 220.184 g/mol
SMILES Oc1ccc(C2=[N+]([N+](=C(C)C2=O)[O-])[O-])cc1
SPLASH splash10-01b9-0970000000-bd2a19778e00cdd604e6
Source of Spectrum D8-328-768-17
Wiley ID 1516028