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Diphenidine
SpectraBase Compound ID FbCJJSu3FiI
InChI InChI=1S/C19H23N/c1-4-10-17(11-5-1)16-19(18-12-6-2-7-13-18)20-14-8-3-9-15-20/h1-2,4-7,10-13,19H,3,8-9,14-16H2
InChIKey JQWJJJYHVHNXJH-UHFFFAOYSA-N
Mol Weight 265.4 g/mol
Molecular Formula C19H23N
Exact Mass 265.18305 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID JaRfMCkf80c
Name Diphenidine MS2
CAS Registry Number 36794-52-2
Comments F: ITMS + c ESI d w Full ms2 266.10
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Formula C19H23N
InChI InChI=1S/C19H23N/c1-4-10-17(11-5-1)16-19(18-12-6-2-7-13-18)20-14-8-3-9-15-20/h1-2,4-7,10-13,19H,3,8-9,14-16H2
InChIKey JQWJJJYHVHNXJH-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES C1=C(C=CC=C1)CC(N1CCCCC1)C1=CC=CC=C1
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