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N-[(1-Ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-sulfamoyl-benzamide
SpectraBase Compound ID 5RbKV4nz6KX
InChI InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)
InChIKey BGRJTUBHPOOWDU-UHFFFAOYSA-N
Mol Weight 341.43 g/mol
Molecular Formula C15H23N3O4S
Exact Mass 341.140927 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 4WrcuAv20HT
Name Sulpiride MS2
CAS Registry Number 15676-16-1
Comments T: ITMS + c ESI d w Full ms2 [email protected] [80.00-355.00]
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Formula C15H23N3O4S
InChI InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)
InChIKey BGRJTUBHPOOWDU-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES NS(C=1C=C(C(=O)NCC2CCCN2CC)C(=CC1)OC)(=O)=O
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