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4-Amino-6-benzylthio-5-cyano-2-ethylthiopyrimidine
SpectraBase Compound ID 7Mj1K3zSkye
InChI InChI=1S/C14H14N4S2/c1-2-19-14-17-12(16)11(8-15)13(18-14)20-9-10-6-4-3-5-7-10/h3-7H,2,9H2,1H3,(H2,16,17,18)
InChIKey XKGDSJRFVNQAKB-UHFFFAOYSA-N
Mol Weight 302.41 g/mol
Molecular Formula C14H14N4S2
Exact Mass 302.065989 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVNqx2IbMEc
Name 4-Amino-6-benzylthio-5-cyano-2-ethylthiopyrimidine
Alternate Name(s) 4-Amino-6-(benzylthio)-2-(ethylthio)pyrimidine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N4S2
InChI InChI=1S/C14H14N4S2/c1-2-19-14-17-12(16)11(8-15)13(18-14)20-9-10-6-4-3-5-7-10/h3-7H,2,9H2,1H3,(H2,16,17,18)
InChIKey XKGDSJRFVNQAKB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cjoc.200990139
Molecular Weight 302.414 g/mol
SMILES Nc1nc(nc(c1C#N)SCc1ccccc1)SCC
SPLASH splash10-0006-9011000000-6ddfbd8df2e24eb63320
Source of Spectrum CJC-27-837-3j
Wiley ID 1772317