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Capsaicine-M (N-oxide) MS3_1
SpectraBase Compound ID 9IG0BRmnDRc
InChI InChI=1S/C11H20NO2/c1-10(2)8-6-4-5-7-9-11(13)12(3)14/h6,8,10,14H,3-5,7,9H2,1-2H3/q+1/b8-6+
InChIKey ZCKCPJFOJBHUQN-SOFGYWHQSA-N
Mol Weight 198.29 g/mol
Molecular Formula C11H20NO2
Exact Mass 198.149404 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 6AefNmsZ7I
Name Capsaicine-M (N-oxide) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-210.00]
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InChI InChI=1S/C11H20NO2/c1-10(2)8-6-4-5-7-9-11(13)12(3)14/h6,8,10,14H,3-5,7,9H2,1-2H3/q+1/b8-6+
InChIKey ZCKCPJFOJBHUQN-SOFGYWHQSA-N
Ion Polarity P
Ionization Type ESI
SMILES O[N+](=C)C(CCCC\C=C\C(C)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