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Milnaciprane-M (N-oxide) MS2
SpectraBase Compound ID KK2TrveUQ9C
InChI InChI=1S/C15H22N2O2/c1-3-17(4-2)14(18)15(10-13(15)11-16-19)12-8-6-5-7-9-12/h5-9,13,16,19H,3-4,10-11H2,1-2H3
InChIKey SJXLPNFAPKROQJ-UHFFFAOYSA-N
Mol Weight 262.35 g/mol
Molecular Formula C15H22N2O2
Exact Mass 262.168128 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 92BKxCx1vMg
Name Milnaciprane-M (N-oxide) MS2
Comments F: ITMS + c ESI d w Full ms2 263.10
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Formula C15H22N2O2
InChI InChI=1S/C15H22N2O2/c1-3-17(4-2)14(18)15(10-13(15)11-16-19)12-8-6-5-7-9-12/h5-9,13,16,19H,3-4,10-11H2,1-2H3
InChIKey SJXLPNFAPKROQJ-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(CC1C(C2=CC=CC=C2)(C(=O)N(CC)CC)C1)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 ms2
Technique ITMS