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4-Amino-6-(4-bromophenyl)-2-methylthiopyrimidine-5-carbonitrile
SpectraBase Compound ID 4OQG01Qjxsf
InChI InChI=1S/C12H9BrN4S/c1-18-12-16-10(9(6-14)11(15)17-12)7-2-4-8(13)5-3-7/h2-5H,1H3,(H2,15,16,17)
InChIKey QBVCYHKALKJOBI-UHFFFAOYSA-N
Mol Weight 321.2 g/mol
Molecular Formula C12H9BrN4S
Exact Mass 319.97313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfF78S4TzF1
Name 4-Amino-6-(4-bromophenyl)-2-methylthiopyrimidine-5-carbonitrile
Alternate Name(s) 4-Amino-6-(4-bromophenyl)-2-(methylthio)pyrimidine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9BrN4S
InChI InChI=1S/C12H9BrN4S/c1-18-12-16-10(9(6-14)11(15)17-12)7-2-4-8(13)5-3-7/h2-5H,1H3,(H2,15,16,17)
InChIKey QBVCYHKALKJOBI-UHFFFAOYSA-N
Molecular Weight 321.196 g/mol
SMILES Nc1c(C#N)c(nc(n1)SC)-c1ccc(cc1)Br
SPLASH splash10-00di-1439000000-fcc9056d75503d0e0c38
Source of Spectrum Y-51-421-4c
Wiley ID 1741267