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Moxifloxacine MS2
SpectraBase Compound ID 7cM9vFnDldV
InChI InChI=1S/C21H24FN3O4/c1-29-20-17-13(19(26)14(21(27)28)9-25(17)12-4-5-12)7-15(22)18(20)24-8-11-3-2-6-23-16(11)10-24/h7,9,11-12,16,23H,2-6,8,10H2,1H3,(H,27,28)
InChIKey FABPRXSRWADJSP-UHFFFAOYSA-N
Mol Weight 401.44 g/mol
Molecular Formula C21H24FN3O4
Exact Mass 401.175084 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 1kVLMYhBVtY
Name Moxifloxacine
CAS Registry Number 151096-09-2
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-430.00]
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Formula C21H24FN3O4
InChI InChI=1S/C21H24FN3O4/c1-29-20-17-13(19(26)14(21(27)28)9-25(17)12-4-5-12)7-15(22)18(20)24-8-11-3-2-6-23-16(11)10-24/h7,9,11-12,16,23H,2-6,8,10H2,1H3,(H,27,28)
InChIKey FABPRXSRWADJSP-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES N1CCCC2C1CN(C=1C(=C3C(C(C(C(=O)O)=CN3C3CC3)=O)=CC1F)OC)C2
Sample Comments The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Selected Ion Charge 1
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Spectrum Type ms2
Technique HCD