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Tolperisone-M (HO-aryl) MS2
SpectraBase Compound ID F6t1FVeuanp
InChI InChI=1S/C16H23NO2/c1-12-6-7-14(10-15(12)18)16(19)13(2)11-17-8-4-3-5-9-17/h6-7,10,13,18H,3-5,8-9,11H2,1-2H3
InChIKey DPTIOTYHVFZYFS-UHFFFAOYSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 7RlgVqraXLY
Name Tolperisone-M (HO-aryl) MS2
Comments F: ITMS + c ESI d w Full ms2 262.10
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Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-12-6-7-14(10-15(12)18)16(19)13(2)11-17-8-4-3-5-9-17/h6-7,10,13,18H,3-5,8-9,11H2,1-2H3
InChIKey DPTIOTYHVFZYFS-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC=1C(=CC=C(C1)C(C(CN1CCCCC1)C)=O)C
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