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A-796.260-M (N,N-bisdealkyl-) MS3_1
SpectraBase Compound ID GeIPg1u6q4a
InChI InChI=1S/C11H11N2O/c12-5-6-13-7-9(8-14)10-3-1-2-4-11(10)13/h1-4,7H,5-6,12H2/q+1
InChIKey PBBOXQOOHNZWFX-UHFFFAOYSA-N
Mol Weight 187.22 g/mol
Molecular Formula C11H11N2O
Exact Mass 187.087138 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID FMmCq8Sec3o
Name A-796.260-M (N,N-bisdealkyl-) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-200.00]
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Formula C11H11N2O
InChI InChI=1S/C11H11N2O/c12-5-6-13-7-9(8-14)10-3-1-2-4-11(10)13/h1-4,7H,5-6,12H2/q+1
InChIKey PBBOXQOOHNZWFX-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES NCCN1C=2C=CC=CC2C(=C1)[C+]=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: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS