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3-Quinolinecarbonitrile, 2-(3,4-dimethoxyphenyl)-4-[2-(dimethylamino)ethenyl]-
SpectraBase Compound ID KuDGPOa5iGf
InChI InChI=1S/C22H21N3O2/c1-25(2)12-11-16-17-7-5-6-8-19(17)24-22(18(16)14-23)15-9-10-20(26-3)21(13-15)27-4/h5-13H,1-4H3/b12-11+
InChIKey ISDSROFXIZBPSR-VAWYXSNFSA-N
Mol Weight 359.43 g/mol
Molecular Formula C22H21N3O2
Exact Mass 359.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhoQ1OM84M4
Name 3-Quinolinecarbonitrile, 2-(3,4-dimethoxyphenyl)-4-[2-(dimethylamino)ethenyl]-
Alternate Name(s) 2-(3,4-Dimethoxyphenyl)-4-(2-dimethylaminovinyl)quinoline-3-caronitrile 2-(3,4-dimethoxyphenyl)-4-[(E)-2-(dimethylamino)ethenyl]-3-quinolinecarbonitrile
CAS Registry Number 112238-18-3
Comments Less than 3 mono-isotopic peaks
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Formula C22H21N3O2
InChI InChI=1S/C22H21N3O2/c1-25(2)12-11-16-17-7-5-6-8-19(17)24-22(18(16)14-23)15-9-10-20(26-3)21(13-15)27-4/h5-13H,1-4H3/b12-11+
InChIKey ISDSROFXIZBPSR-VAWYXSNFSA-N
Molecular Weight 359.429 g/mol
SMILES c1(c(nc2c(c1\C=C\N(C)C)cccc2)-c1cc(OC)c(cc1)OC)C#N
SPLASH splash10-066r-0009000000-f8e3f5402d551bd172a3
Source of Spectrum B-40-633-5
Wiley ID 1347860