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PVP-M (HO-ring-) MS2
SpectraBase Compound ID 8V5n7lQB7Oo
InChI InChI=1S/C15H21NO2/c1-2-7-13(16-11-6-10-14(16)17)15(18)12-8-4-3-5-9-12/h3-5,8-9,13-14,17H,2,6-7,10-11H2,1H3
InChIKey ANWAGMVYYFXSOT-UHFFFAOYSA-N
Mol Weight 247.34 g/mol
Molecular Formula C15H21NO2
Exact Mass 247.157229 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID AitkJgqP1xm
Name PVP-M (HO-ring-) MS2
Comments T: ITMS + c ESI d w Full ms2 [email protected] [55.00-260.00]
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Formula C15H21NO2
InChI InChI=1S/C15H21NO2/c1-2-7-13(16-11-6-10-14(16)17)15(18)12-8-4-3-5-9-12/h3-5,8-9,13-14,17H,2,6-7,10-11H2,1H3
InChIKey ANWAGMVYYFXSOT-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC1N(C(C(C2=CC=CC=C2)=O)CCC)CCC1
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