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4-(4-Bromophenyl)-6-(3,4-dimethoxyphenyl)-2-ethoxynicotinonitrile
SpectraBase Compound ID 44mbE4GL8Jf
InChI InChI=1S/C22H19BrN2O3/c1-4-28-22-18(13-24)17(14-5-8-16(23)9-6-14)12-19(25-22)15-7-10-20(26-2)21(11-15)27-3/h5-12H,4H2,1-3H3
InChIKey VVWMLVQQGBAZRR-UHFFFAOYSA-N
Mol Weight 439.31 g/mol
Molecular Formula C22H19BrN2O3
Exact Mass 438.057905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B12iuLlM35U
Name 4-(4-Bromophenyl)-6-(3,4-dimethoxyphenyl)-2-ethoxynicotinonitrile
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19BrN2O3
InChI InChI=1S/C22H19BrN2O3/c1-4-28-22-18(13-24)17(14-5-8-16(23)9-6-14)12-19(25-22)15-7-10-20(26-2)21(11-15)27-3/h5-12H,4H2,1-3H3
InChIKey VVWMLVQQGBAZRR-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP 1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3392
Molecular Weight 439.309 g/mol
SMILES c1cc(ccc1-c1cc(nc(OCC)c1C#N)-c1ccc(c(c1)OC)OC)Br
SPLASH splash10-000i-0011900000-35a0f3072081b96fb390
Source of Spectrum Y-56-176-4
Wiley ID 1859274