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RCS-04-ortho-isomer-M (di-HO-) isomer 4 MS3_1
SpectraBase Compound ID 7QTAnhzo4tC
InChI InChI=1S/C8H7O2.CH4O2/c1-10-8-5-3-2-4-7(8)6-9;2-1-3/h2-5H,1H3;2-3H,1H2/q+1;
InChIKey FRWQDCKAUJTBLD-UHFFFAOYSA-N
Mol Weight 183.18 g/mol
Molecular Formula C9H11O4
Exact Mass 183.065734 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID GRdsu5jTHMr
Name RCS-04-ortho-isomer-M (di-HO-) isomer 4 MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-180.00]
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Formula C8H7O4
Ion Polarity P
Ionization Type ESI
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