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Oxazepam-M (HO-glucuronide) MS3_2
SpectraBase Compound ID 2xb1UgPZUtk
InChI InChI=1S/C15H9ClN2O2/c16-10-3-6-13-12(7-10)15(17-8-14(20)18-13)9-1-4-11(19)5-2-9/h1-8H,(H-,17,18,19,20)/p+1
InChIKey LMOGJLTUOQOZCO-UHFFFAOYSA-O
Mol Weight 285.71 g/mol
Molecular Formula C15H10ClN2O2
Exact Mass 285.04308 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID IvFx7FUcyD1
Name Oxazepam-M (HO-glucuronide) MS3_2
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [65.00-300.00]
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InChI InChI=1S/C15H9ClN2O2/c16-10-3-6-13-12(7-10)15(17-8-14(20)18-13)9-1-4-11(19)5-2-9/h1-8H,(H-,17,18,19,20)/p+1
InChIKey LMOGJLTUOQOZCO-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES N1C2=C(C(C3=CC=C(C=C3)O)=N[CH+]C1=O)C=C(C=C2)Cl
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