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HMMC-M (glucuronide) MS3_1
SpectraBase Compound ID AB9D4DNvoW2
InChI InChI=1S/C11H15NO3/c1-7(12-2)11(14)8-4-5-10(15-3)9(13)6-8/h4-7,12-13H,1-3H3
InChIKey LUAGWRTYCQFPCI-UHFFFAOYSA-N
Mol Weight 209.24 g/mol
Molecular Formula C11H15NO3
Exact Mass 209.105193 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID DU2LB8oh0Kz
Name HMMC MS2
Comments F: ITMS + c ESI d w Full ms2 210.10
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Formula C11H15NO3
InChI InChI=1S/C11H15NO3/c1-7(12-2)11(14)8-4-5-10(15-3)9(13)6-8/h4-7,12-13H,1-3H3
InChIKey LUAGWRTYCQFPCI-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC=1C(=CC=C(C(C(C)NC)=O)C1)OC
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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS