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3-Amino-3',4',5'-trimethoxy-5-methylsulfanylbiphenyl-2,4-dicarbonitrile
SpectraBase Compound ID 1xKegIl9zA3
InChI InChI=1S/C18H17N3O3S/c1-22-14-5-10(6-15(23-2)18(14)24-3)11-7-16(25-4)13(9-20)17(21)12(11)8-19/h5-7H,21H2,1-4H3
InChIKey RSQQGOOUAIKUDH-UHFFFAOYSA-N
Mol Weight 355.41 g/mol
Molecular Formula C18H17N3O3S
Exact Mass 355.099063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XyGCzuagR9
Name 3-Amino-3',4',5'-trimethoxy-5-methylsulfanylbiphenyl-2,4-dicarbonitrile
Alternate Name(s) 2-Amino-4-(methylthio)-6-(3,4,5-trimethoxyphenyl)benzene-1,3-dicarbonitrile 2-Amino-4-methylsulfanyl-6-(3,4,5-trimethoxyphenyl)benzene-1,3-dicarbonitrile 2-Azanyl-4-methylsulfanyl-6-(3,4,5-trimethoxyphenyl)benzene-1,3-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17N3O3S
InChI InChI=1S/C18H17N3O3S/c1-22-14-5-10(6-15(23-2)18(14)24-3)11-7-16(25-4)13(9-20)17(21)12(11)8-19/h5-7H,21H2,1-4H3
InChIKey RSQQGOOUAIKUDH-UHFFFAOYSA-N
Molecular Weight 355.412 g/mol
SMILES Nc1c(c(SC)cc(c1C#N)-c1cc(OC)c(c(c1)OC)OC)C#N
SPLASH splash10-004i-0029000000-cfdf8c68b6b2f91b6df6
Source of Spectrum Y-45-276-11e
Wiley ID 1666187