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4-(1H-Pyrrol-2-yl)benzonitrile

View entire compound with spectra: 1 MS (GC)

4-(1H-Pyrrol-2-yl)benzonitrile
SpectraBase Compound ID 7WRPvBcDvW3
InChI InChI=1S/C11H8N2/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7,13H
InChIKey SYSSDYLXBRLBJK-UHFFFAOYSA-N
Mol Weight 168.2 g/mol
Molecular Formula C11H8N2
Exact Mass 168.068748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPY5xAPH3N1
Name 4-(1H-Pyrrol-2-yl)benzonitrile
Appearance Slightly yellow solid
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 168.068748266 u
Formula C11H8N2
InChI InChI=1S/C11H8N2/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7,13H
InChIKey SYSSDYLXBRLBJK-UHFFFAOYSA-N
Instrument Name Agilent 6890N GC-5975 MS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201705326
Molecular Weight 168.199 g/mol
Quality 105
SMILES N1C=CC=C1C1=CC=C(C=C1)C#N
SPLASH splash10-014i-0900000000-1f7fc16222f3d733da38
Source of Spectrum QE-24-SM10-10-1 (DOI: 10.1002/chem.201705326)
Wiley ID 1901404