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5-(2,6-Dibenzylphenyl)-1H-pyrrole-3-carbonitrile

View entire compound with spectra: 1 MS (GC)

5-(2,6-Dibenzylphenyl)-1H-pyrrole-3-carbonitrile
SpectraBase Compound ID 8fz8BOQSQNg
InChI InChI=1S/C25H20N2/c26-17-21-16-24(27-18-21)25-22(14-19-8-3-1-4-9-19)12-7-13-23(25)15-20-10-5-2-6-11-20/h1-13,16,18,27H,14-15H2
InChIKey PCKLBDSZSDOUEY-UHFFFAOYSA-N
Mol Weight 348.45 g/mol
Molecular Formula C25H20N2
Exact Mass 348.162649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjQe5WjlxHd
Name 5-(2,6-Dibenzylphenyl)-1H-pyrrole-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20N2
InChI InChI=1S/C25H20N2/c26-17-21-16-24(27-18-21)25-22(14-19-8-3-1-4-9-19)12-7-13-23(25)15-20-10-5-2-6-11-20/h1-13,16,18,27H,14-15H2
InChIKey PCKLBDSZSDOUEY-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.orglett.6b00141
Molecular Weight 348.449 g/mol
SMILES [nH]1cc(cc1-c1c(cccc1Cc1ccccc1)Cc1ccccc1)C#N
SPLASH splash10-0002-1139000000-52cfe4d06a57651bce90
Source of Spectrum A1-18-852/SM26-9h
Wiley ID 1805217