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3-Amino-2',4'-dimethoxy-5-methylsulfanylbiphenyl-2,4-dicarbonitrile
SpectraBase Compound ID CCcMD38fKtA
InChI InChI=1S/C17H15N3O2S/c1-21-10-4-5-11(15(6-10)22-2)12-7-16(23-3)14(9-19)17(20)13(12)8-18/h4-7H,20H2,1-3H3
InChIKey LPSJAYFXAUGQNG-UHFFFAOYSA-N
Mol Weight 325.39 g/mol
Molecular Formula C17H15N3O2S
Exact Mass 325.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dPnnTfXnFB
Name 3-Amino-2',4'-dimethoxy-5-methylsulfanylbiphenyl-2,4-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N3O2S
InChI InChI=1S/C17H15N3O2S/c1-21-10-4-5-11(15(6-10)22-2)12-7-16(23-3)14(9-19)17(20)13(12)8-18/h4-7H,20H2,1-3H3
InChIKey LPSJAYFXAUGQNG-UHFFFAOYSA-N
Molecular Weight 325.386 g/mol
SMILES Nc1c(c(-c2c(cc(cc2)OC)OC)cc(c1C#N)SC)C#N
SPLASH splash10-004i-0029000000-33b0ede4a63e99420338
Source of Spectrum Y-45-276-11d
Synonyms 2-Amino-4-(2,4-dimethoxyphenyl)-6-(methylthio)benzene-1,3-dicarbonitrile 2-Amino-4-(2,4-dimethoxyphenyl)-6-methylsulfanylbenzene-1,3-dicarbonitrile 2-Amino-4-(2,4-dimethoxyphenyl)-6-methylsulfanyl-benzene-1,3-dicarbonitrile 2-Azanyl-4-(2,4-dimethoxyphenyl)-6-methylsulfanyl-benzene-1,3-dicarbonitrile
Wiley ID 1666188