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Midazolam-M (benzophenone-glucuronide) MS3_2
SpectraBase Compound ID e9gEpuKX7p
InChI InChI=1S/C18H13ClFN2O/c1-11-10-21-12(2)22(11)17-8-7-13(19)9-15(17)18(23)14-5-3-4-6-16(14)20/h3-10H,1H2,2H3/q+1
InChIKey FRIZIJYWMLTQTI-UHFFFAOYSA-N
Mol Weight 327.77 g/mol
Molecular Formula C18H13ClFN2O
Exact Mass 327.070044 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID E9Wr4QkmWAZ
Name Midazolam-M (benzophenone-glucuronide) MS3_2
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [80.00-340.00]
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InChI InChI=1S/C18H13ClFN2O/c1-11-10-21-12(2)22(11)17-8-7-13(19)9-15(17)18(23)14-5-3-4-6-16(14)20/h3-10H,1H2,2H3/q+1
InChIKey FRIZIJYWMLTQTI-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES [CH2+]C1=CN=C(N1C1=C(C=C(C=C1)Cl)C(C1=C(C=CC=C1)F)=O)C
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