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PCPR-M (2''-HO-) MS2
SpectraBase Compound ID JniCDU3KqHs
InChI InChI=1S/C15H23NO/c1-13(17)12-16-15(10-6-3-7-11-15)14-8-4-2-5-9-14/h2,4-5,8-9,13,16-17H,3,6-7,10-12H2,1H3
InChIKey BKZJKMQNSRUTMT-UHFFFAOYSA-N
Mol Weight 233.35 g/mol
Molecular Formula C15H23NO
Exact Mass 233.177964 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID Aw83AgGlFqd
Name PCPR-M (2''-HO-) MS2
Comments F: ITMS + c ESI d w Full ms2 234.10
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Formula C15H23NO
InChI InChI=1S/C15H23NO/c1-13(17)12-16-15(10-6-3-7-11-15)14-8-4-2-5-9-14/h2,4-5,8-9,13,16-17H,3,6-7,10-12H2,1H3
InChIKey BKZJKMQNSRUTMT-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N(C1(CCCCC1)C1=CC=CC=C1)CC(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 ms2
Technique ITMS