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A-796.260-M (N,O-bisdealkyl-) MS3_1
SpectraBase Compound ID Iy1AxOhXcji
InChI InChI=1S/C13H15N2O2/c16-8-6-14-5-7-15-9-11(10-17)12-3-1-2-4-13(12)15/h1-4,9,14,16H,5-8H2/q+1
InChIKey QOKVTTCOBXZLOU-UHFFFAOYSA-N
Mol Weight 231.27 g/mol
Molecular Formula C13H15N2O2
Exact Mass 231.113353 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 7fuflirWgTe
Name A-796.260-M (N,O-bisdealkyl-) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-245.00]
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Formula C13H15N2O2
InChI InChI=1S/C13H15N2O2/c16-8-6-14-5-7-15-9-11(10-17)12-3-1-2-4-13(12)15/h1-4,9,14,16H,5-8H2/q+1
InChIKey QOKVTTCOBXZLOU-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(CCN1C=2C=CC=CC2C(=C1)[C+]=O)CCO
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: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS