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5-Cyano-6-methyl-4-oxo-2-thioxo-1,2,3,4-dihydropyrimidine
SpectraBase Compound ID BeCmrraQCMC
InChI InChI=1S/C6H5N3OS/c1-3-4(2-7)5(10)9-6(11)8-3/h1H3,(H2,8,9,10,11)
InChIKey GKXYINDEGMVTOE-UHFFFAOYSA-N
Mol Weight 167.19 g/mol
Molecular Formula C6H5N3OS
Exact Mass 167.015333 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 31umySe90nj
Name 5-Cyano-6-methyl-4-oxo-2-thioxo-1,2,3,4-dihydropyrimidine
Alternate Name(s) 6-Methyl-4-oxo-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarbonitrile 6-Methyl-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile 6-Methyl-4-oxo-2-thioxo-1H-pyrimidine-5-carbonitrile 6-Methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H5N3OS
InChI InChI=1S/C6H5N3OS/c1-3-4(2-7)5(10)9-6(11)8-3/h1H3,(H2,8,9,10,11)
InChIKey GKXYINDEGMVTOE-UHFFFAOYSA-N
Molecular Weight 167.186 g/mol
SMILES N1C(NC(=C(C1=O)C#N)C)=S
SPLASH splash10-066r-1900000000-1efa6e8699951026a09e
Source of Spectrum H1-41-83-18
Wiley ID 757084