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Diphenylprolinol-M (di-HO-) MS2
SpectraBase Compound ID 1mK0waVxj83
InChI InChI=1S/C17H19NO3/c19-15-10-8-14(9-11-15)17(21,13-5-2-1-3-6-13)18-12-4-7-16(18)20/h1-3,5-6,8-11,16,19-21H,4,7,12H2
InChIKey OTOLCKCJYGPFJW-UHFFFAOYSA-N
Mol Weight 285.34 g/mol
Molecular Formula C17H19NO3
Exact Mass 285.136493 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 9UePniAaSO
Name Diphenylprolinol-M (di-HO-) MS2
Comments F: ITMS + c ESI d w Full ms2 286.10
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Formula C17H19NO3
InChI InChI=1S/C17H19NO3/c19-15-10-8-14(9-11-15)17(21,13-5-2-1-3-6-13)18-12-4-7-16(18)20/h1-3,5-6,8-11,16,19-21H,4,7,12H2
InChIKey OTOLCKCJYGPFJW-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC1=CC=C(C(C2=CC=CC=C2)(N2CCCC2O)O)C=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 ms2
Technique ITMS