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Voriconazole-M (ring-HO-) MS3_1
SpectraBase Compound ID 2wyDTdjCaPU
InChI InChI=1S/C10H7F2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6H,4H2/p+1
InChIKey XCHRPVARHBCFMJ-UHFFFAOYSA-O
Mol Weight 224.19 g/mol
Molecular Formula C10H8F2N3O
Exact Mass 224.063543 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID JFmOyo0rPrR
Name Voriconazole MS3_2
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-235.00]
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InChI InChI=1S/C10H7F2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6H,4H2/p+1
InChIKey XCHRPVARHBCFMJ-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES [OH+]=C(C1=C(C=C(C=C1)F)F)CN1N=CN=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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS