For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-(1-Methyl-1H-pyrrol-2-yl) benzonitrile

View entire compound with spectra: 4 MS (GC)

4-(1-Methyl-1H-pyrrol-2-yl) benzonitrile
SpectraBase Compound ID 9ixaohybTY
InChI InChI=1S/C12H10N2/c1-14-8-2-3-12(14)11-6-4-10(9-13)5-7-11/h2-8H,1H3
InChIKey XQULKEFRCLIVTR-UHFFFAOYSA-N
Mol Weight 182.23 g/mol
Molecular Formula C12H10N2
Exact Mass 182.084398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID IN9OMNsHyP7
Name 4-(1-Methyl-1H-pyrrol-2-yl)benzonitrile
Appearance Slightly yellow solid
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2
InChI InChI=1S/C12H10N2/c1-14-8-2-3-12(14)11-6-4-10(9-13)5-7-11/h2-8H,1H3
InChIKey XQULKEFRCLIVTR-UHFFFAOYSA-N
Instrument Name Agilent 6890N GC-5975 MS
Ionization Type EI
Literature Reference DOI 10.1002/chem.201705326
Molecular Weight 182.226 g/mol
Quality 43
SMILES CN1C(=CC=C1)C1=CC=C(C=C1)C#N
SPLASH splash10-001i-0900000000-2932b7490c9520e1938a
Source of Spectrum QE-24-SM4-4-1 (DOI: 10.1002/chem.201705326)
Wiley ID 1901409