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Cloniprazepam MS3_1
SpectraBase Compound ID 5ZVixZKeK4v
InChI InChI=1S/C15H10ClN3O3/c16-12-4-2-1-3-10(12)15-11-7-9(19(21)22)5-6-13(11)18-14(20)8-17-15/h1-7H,8H2,(H,18,20)/p+1
InChIKey DGBIGWXXNGSACT-UHFFFAOYSA-O
Mol Weight 316.72 g/mol
Molecular Formula C15H11ClN3O3
Exact Mass 316.048894 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 8qSLeSjYiz8
Name Cloniprazepam MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [75.00-330.00]
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Formula C15H11ClN3O3
InChI InChI=1S/C15H10ClN3O3/c16-12-4-2-1-3-10(12)15-11-7-9(19(21)22)5-6-13(11)18-14(20)8-17-15/h1-7H,8H2,(H,18,20)/p+1
InChIKey DGBIGWXXNGSACT-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N1C(C[NH+]=C(C2=C1C=CC(=C2)N(=O)=O)C=1C(=CC=CC1)Cl)=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