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Sulfadiazine MS2
SpectraBase Compound ID 5TrEyMINsI2
InChI InChI=1S/C10H10N4O2S/c11-8-3-1-4-9(7-8)17(15,16)14-10-12-5-2-6-13-10/h1-7H,11H2,(H,12,13,14)
InChIKey ODWQKLIHSSJGEU-UHFFFAOYSA-N
Mol Weight 250.28 g/mol
Molecular Formula C10H10N4O2S
Exact Mass 250.052447 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID ukekLcRp5i
Name Sulfadiazine MS2
CAS Registry Number 68-35-9
Comments F: ITMS + c ESI d w Full ms2 251.10
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Formula C10H10N4O2S
InChI InChI=1S/C10H10N4O2S/c11-8-3-1-4-9(7-8)17(15,16)14-10-12-5-2-6-13-10/h1-7H,11H2,(H,12,13,14)
InChIKey ODWQKLIHSSJGEU-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(S(C1=CC=CC(=C1)N)(=O)=O)C1=NC=CC=N1
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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS