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Methoxetamine-M (O-demethyl-) MS3_2
SpectraBase Compound ID lJ19tRQJhC
InChI InChI=1S/C11H12O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h3,6-8H,1-2,4-5H2/p+1
InChIKey WLKQADLUPCXCGE-UHFFFAOYSA-O
Mol Weight 161.22 g/mol
Molecular Formula C11H13O
Exact Mass 161.09664 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 7p0oJGEQG8
Name Methoxetamine-M (N-deethyl-O-demethyl-) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-175.00]
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Formula C11H13O
InChI InChI=1S/C11H12O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h3,6-8H,1-2,4-5H2/p+1
InChIKey WLKQADLUPCXCGE-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES OC=1C=CC=C(C1)[C+]1CCCC1
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