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Minaprine-M (HO-) MS3_1
SpectraBase Compound ID BEbVM1wdDQq
InChI InChI=1S/C13H13N3O/c1-3-14-13-9(2)8-11(15-16-13)10-6-4-5-7-12(10)17/h4-8H,1,3H2,2H3,(H-,14,15,16,17)/p+1
InChIKey GSYHLLASRWWGEN-UHFFFAOYSA-O
Mol Weight 228.27 g/mol
Molecular Formula C13H14N3O
Exact Mass 228.113687 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID DuuHgLN25Fz
Name Minaprine-M (HO-deethylene-) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-240.00]
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InChI InChI=1S/C13H13N3O/c1-3-14-13-9(2)8-11(15-16-13)10-6-4-5-7-12(10)17/h4-8H,1,3H2,2H3,(H-,14,15,16,17)/p+1
InChIKey GSYHLLASRWWGEN-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N(C[CH2+])C1=NN=C(C2=C(C=CC=C2)O)C=C1C
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