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1,3-Bis(3,4-dimethoxyphenyl)-1-cyano-2-imino-1-propene
SpectraBase Compound ID Bfjc2U7AUvo
InChI InChI=1S/C20H22N2O4/c1-23-17-7-5-13(10-19(17)25-3)9-16(22)15(12-21)14-6-8-18(24-2)20(11-14)26-4/h5-8,10-11,15,22H,9H2,1-4H3
InChIKey IAJZUQRGIFLSOM-UHFFFAOYSA-N
Mol Weight 354.41 g/mol
Molecular Formula C20H22N2O4
Exact Mass 354.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 87afJJ9WSii
Name 1,3-Bis(3,4-dimethoxyphenyl)-1-cyano-2-imino-1-propene
Alternate Name(s) 2,4-bis(3,4-dimethoxyphenyl)-3-iminobutanenitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O4
InChI InChI=1S/C20H22N2O4/c1-23-17-7-5-13(10-19(17)25-3)9-16(22)15(12-21)14-6-8-18(24-2)20(11-14)26-4/h5-8,10-11,15,22H,9H2,1-4H3
InChIKey IAJZUQRGIFLSOM-UHFFFAOYSA-N
Molecular Weight 354.406 g/mol
SMILES N=C(C(c1cc(OC)c(cc1)OC)C#N)Cc1cc(OC)c(cc1)OC
SPLASH splash10-0fb9-0709000000-14d9647920288462742e
Source of Spectrum O1-30-1874-14
Wiley ID 818718