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Methocarbamol-M (O-demethyl-) MS2
SpectraBase Compound ID Eomhnr66hZE
InChI InChI=1S/C10H13NO5/c11-10(14)16-6-7(12)5-15-9-4-2-1-3-8(9)13/h1-4,7,12-13H,5-6H2,(H2,11,14)
InChIKey KJCFQCNOLVLWTJ-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C10H13NO5
Exact Mass 227.079373 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 1ExOb69rLZz
Name Methocarbamol-M (O-demethyl-)
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-250.00]
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Formula C10H13NO5
InChI InChI=1S/C10H13NO5/c11-10(14)16-6-7(12)5-15-9-4-2-1-3-8(9)13/h1-4,7,12-13H,5-6H2,(H2,11,14)
InChIKey KJCFQCNOLVLWTJ-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES OC=1C=CC=CC1OCC(COC(N)=O)O
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