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Buflomedil-M (N-oxide) MS2
SpectraBase Compound ID 2DshIIeqQd9
InChI InChI=1S/C17H26NO5/c1-21-13-11-15(22-2)17(16(12-13)23-3)14(19)7-6-10-18(20)8-4-5-9-18/h11-12,20H,4-10H2,1-3H3/q+1
InChIKey RBCSWSTZAHTUFR-UHFFFAOYSA-N
Mol Weight 324.4 g/mol
Molecular Formula C17H26NO5
Exact Mass 324.181098 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID AT9VAYeckre
Name Buflomedil-M (N-oxide) MS2
Comments F: ITMS + c ESI d w Full ms2 324.10
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InChI InChI=1S/C17H26NO5/c1-21-13-11-15(22-2)17(16(12-13)23-3)14(19)7-6-10-18(20)8-4-5-9-18/h11-12,20H,4-10H2,1-3H3/q+1
InChIKey RBCSWSTZAHTUFR-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES O[N+]1(CCCC1)CCCC(=O)C=1C(=CC(=CC1OC)OC)OC
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