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Terbinafine-M (nor-dihydrodiol-) isomer 1 MS2
SpectraBase Compound ID L2gNmX2Tnks
InChI InChI=1S/C20H25NO2/c1-20(2,3)11-7-4-8-12-21-14-15-13-18(22)19(23)17-10-6-5-9-16(15)17/h4-6,8-10,13,18-19,21-23H,12,14H2,1-3H3/b8-4+
InChIKey PSGBHDHPKKZTMO-XBXARRHUSA-N
Mol Weight 311.42 g/mol
Molecular Formula C20H25NO2
Exact Mass 311.188529 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 1u8fj7hFcDE
Name Terbinafine-M (nor-dihydrodiol-) isomer 1 MS2
Comments T: ITMS + c ESI d w Full ms2 [email protected] [75.00-325.00]
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Formula C20H25NO2
InChI InChI=1S/C20H25NO2/c1-20(2,3)11-7-4-8-12-21-14-15-13-18(22)19(23)17-10-6-5-9-16(15)17/h4-6,8-10,13,18-19,21-23H,12,14H2,1-3H3/b8-4+
InChIKey PSGBHDHPKKZTMO-XBXARRHUSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC1C2=CC=CC=C2C(CNC\C=C\C#CC(C)(C)C)=CC1O
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