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N-Phenyl-1H-indolyl-3-carboxamide
SpectraBase Compound ID JamrLeJHCPD
InChI InChI=1S/C15H12N2O/c18-15(17-11-6-2-1-3-7-11)13-10-16-14-9-5-4-8-12(13)14/h1-10,16H,(H,17,18)
InChIKey ARNKSDBIZXVFHP-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C15H12N2O
Exact Mass 236.094963 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 68NZ0uN0Hxl
Name SDB-006-N-phenyl analog-M (N-dealkyl-) MS2
Comments F: ITMS + c ESI d w Full ms2 237.30
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Formula C15H12N2O
InChI InChI=1S/C15H12N2O/c18-15(17-11-6-2-1-3-7-11)13-10-16-14-9-5-4-8-12(13)14/h1-10,16H,(H,17,18)
InChIKey ARNKSDBIZXVFHP-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES N1C=C(C(NC2=CC=CC=C2)=O)C2=C1C=CC=C2
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 ms2
Technique ITMS