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Melperone-M (HO-) MS3_1
SpectraBase Compound ID OB9zFX9usz
InChI InChI=1S/C10H10FO/c1-2-3-10(12)8-4-6-9(11)7-5-8/h4-7H,1-3H2/q+1
InChIKey IITARUBYWWCXDD-UHFFFAOYSA-N
Mol Weight 165.19 g/mol
Molecular Formula C10H10FO
Exact Mass 165.071568 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 3PuOpKP2eYz
Name Azaperone-M (HO-ring cleveage) MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected]
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InChI InChI=1S/C10H10FO/c1-2-3-10(12)8-4-6-9(11)7-5-8/h4-7H,1-3H2/q+1
InChIKey IITARUBYWWCXDD-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES [CH2+]CCC(=O)C=1C=CC(=CC1)F
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