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Dimetacrine MS3_1
SpectraBase Compound ID KRY0U7Tmchv
InChI InChI=1S/C18H20N/c1-4-13-19-16-11-7-5-9-14(16)18(2,3)15-10-6-8-12-17(15)19/h5-12H,1,4,13H2,2-3H3/q+1
InChIKey INSCCARDXUFWJA-UHFFFAOYSA-N
Mol Weight 250.36 g/mol
Molecular Formula C18H20N
Exact Mass 250.159575 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 4Zp4WM8Nl7t
Name Dimetacrine MS3_1
Comments F: ITMS + c ESI d w Full ms3 [email protected] [email protected] [55.00-265.00]
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InChI InChI=1S/C18H20N/c1-4-13-19-16-11-7-5-9-14(16)18(2,3)15-10-6-8-12-17(15)19/h5-12H,1,4,13H2,2-3H3/q+1
InChIKey INSCCARDXUFWJA-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES [CH2+]CCN1C2=CC=CC=C2C(C2=C1C=CC=C2)(C)C
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 ms3
Technique ITMS