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Antipyrine
SpectraBase Compound ID 7SWQMAisiyg
InChI InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3
InChIKey VEQOALNAAJBPNY-UHFFFAOYSA-N
Mol Weight 188.23 g/mol
Molecular Formula C11H12N2O
Exact Mass 188.094963 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 5ZFSIkedqKb
Name Morazone-M (carboxy-phenazone) -CO2 MS2
CAS Registry Number 60-80-0
Comments F: ITMS + c ESI d w Full ms2 189.10
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Formula C11H12N2O
InChI InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3
InChIKey VEQOALNAAJBPNY-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C1=CC=C(N2C(=O)C=C(N2C)C)C=C1
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS