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Fleroxacin-M (N-oxide) MS2
SpectraBase Compound ID FjjOuC3Nb8F
InChI InChI=1S/C17H18F3N3O4/c1-23(27)6-4-21(5-7-23)15-12(19)8-10-14(13(15)20)22(3-2-18)9-11(16(10)24)17(25)26/h8-9,27H,2-7H2,1H3/p+1
InChIKey FKTUAMQVFQLUAP-UHFFFAOYSA-O
Mol Weight 386.35 g/mol
Molecular Formula C17H19F3N3O4
Exact Mass 386.132766 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 8D1Gqr7lc0D
Name Fleroxacin-M (N-oxide) MS2
Comments F: ITMS + c ESI d w Full ms2 386.10
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Formula C17H19F3N3O4
InChI InChI=1S/C17H18F3N3O4/c1-23(27)6-4-21(5-7-23)15-12(19)8-10-14(13(15)20)22(3-2-18)9-11(16(10)24)17(25)26/h8-9,27H,2-7H2,1H3/p+1
InChIKey FKTUAMQVFQLUAP-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES OC(C=1C(C=2C=C(C(N3CC[N+](CC3)(C)O)=C(C2N(C1)CCF)F)F)=O)=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