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4-Amino-benzenesulfonamide
SpectraBase Compound ID GAKnFpE3nls
InChI InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
InChIKey FDDDEECHVMSUSB-UHFFFAOYSA-N
Mol Weight 172.2 g/mol
Molecular Formula C6H8N2O2S
Exact Mass 172.030649 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID FByUYPVWtDD
Name Sulfaguanole-M ##
CAS Registry Number 63-74-1
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-195.00]
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Formula C6H8N2O2S
InChI InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
InChIKey FDDDEECHVMSUSB-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES NC1=CC=C(S(=O)(=O)N)C=C1
Sample Comments The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Selected Ion Charge 1
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Spectrum Type ms2
Technique HCD