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2-(1-Methyl-1H-pyrrol-2-yl)benzonitrile
SpectraBase Compound ID 5tG2Dt676pD
InChI InChI=1S/C12H10N2/c1-14-8-4-7-12(14)11-6-3-2-5-10(11)9-13/h2-8H,1H3
InChIKey VWPDHILHTOUUPG-UHFFFAOYSA-N
Mol Weight 182.23 g/mol
Molecular Formula C12H10N2
Exact Mass 182.084398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KFxvgfqKV4R
Name 2-(1-Methyl-1H-pyrrol-2-yl)benzonitrile
Carrier Gas Hydrogen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10N2
InChI InChI=1S/C12H10N2/c1-14-8-4-7-12(14)11-6-3-2-5-10(11)9-13/h2-8H,1H3
InChIKey VWPDHILHTOUUPG-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 64
SMILES CN1C(=CC=C1)C1=C(C=CC=C1)C#N
SPLASH splash10-001i-0900000000-7757aeb3dbca6b3f4c40
Source of Spectrum QE-24-SM6-6-2 (DOI: 10.1002/chem.201705326)
Wiley ID 1901412