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Bromopride MS3_1
SpectraBase Compound ID VAepBqGU1i
InChI InChI=1S/C10H11BrN2O2/c1-3-13-10(14)6-4-7(11)9(12)8(5-6)15-2/h4-5H,1,3H2,2H3,(H2-,12,13,14)/p+1
InChIKey FNJGJTWTEGQETR-UHFFFAOYSA-O
Mol Weight 272.12 g/mol
Molecular Formula C10H12BrN2O2
Exact Mass 271.008216 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID DG5W0U8KE6K
Name Bromopride MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [60.00-285.00]
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InChI InChI=1S/C10H11BrN2O2/c1-3-13-10(14)6-4-7(11)9(12)8(5-6)15-2/h4-5H,1,3H2,2H3,(H2-,12,13,14)/p+1
InChIKey FNJGJTWTEGQETR-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N(C[CH2+])C(C1=CC(=C(C(=C1)Br)N)OC)=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 ms3
Technique ITMS