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4,5-Dimethoxy-2-(1H-pyrrol-1-yl)benzonitrile

View entire compound with spectra: 1 MS (GC)

4,5-Dimethoxy-2-(1H-pyrrol-1-yl)benzonitrile
SpectraBase Compound ID 1F2WrEKQ0em
InChI InChI=1S/C13H12N2O2/c1-16-12-7-10(9-14)11(8-13(12)17-2)15-5-3-4-6-15/h3-8H,1-2H3
InChIKey STLJEGKOMXIIMG-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C13H12N2O2
Exact Mass 228.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Al2BSJ1Nwq3
Name 4,5-Dimethoxy-2-(1H-pyrrol-1-yl)benzonitrile
Alternate Name(s) Benzonitrile, 4,5-dimethoxy-2-(1H-pyrrol-1-yl)- 4,5-Dimethoxy-2-(1-pyrrolyl)benzonitrile 4,5-Dimethoxy-2-pyrrol-1-ylbenzonitrile 4,5-Dimethoxy-2-pyrrol-1-yl-benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O2
InChI InChI=1S/C13H12N2O2/c1-16-12-7-10(9-14)11(8-13(12)17-2)15-5-3-4-6-15/h3-8H,1-2H3
InChIKey STLJEGKOMXIIMG-UHFFFAOYSA-N
Molecular Weight 228.251 g/mol
SMILES c1c(c(cc(c1-[n]1cccc1)C#N)OC)OC
SPLASH splash10-0h09-9720000000-e393df0c7d973377f8e4
Source of Spectrum IY-2-4780-4
Wiley ID 1655787