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3-MF-M (N-oxide) MS3_1
SpectraBase Compound ID 33obF3A3OIX
InChI InChI=1S/C14H18N/c1-13-6-5-10-15(12-13)11-9-14-7-3-2-4-8-14/h2-5,7-8,13H,9-12H2,1H3/q+1
InChIKey VKZNHCNVRIGRLN-UHFFFAOYSA-N
Mol Weight 200.3 g/mol
Molecular Formula C14H18N
Exact Mass 200.143925 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID KEOgBAZjyAx
Name 3-Methylfentanyl-M (N-oxide) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-215.00]
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InChI InChI=1S/C14H18N/c1-13-6-5-10-15(12-13)11-9-14-7-3-2-4-8-14/h2-5,7-8,13H,9-12H2,1H3/q+1
InChIKey VKZNHCNVRIGRLN-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES [C+]1=CCN(CC1C)CCC1=CC=CC=C1
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