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1-(2-methylprop-2-enyl)-2-sulfanylidenequinazolin-4-one
SpectraBase Compound ID 7uHJyTs35n9
InChI InChI=1S/C12H12N2OS/c1-8(2)7-14-10-6-4-3-5-9(10)11(15)13-12(14)16/h3-6H,1,7H2,2H3,(H,13,15,16)
InChIKey YKQKCXRUNWOVRI-UHFFFAOYSA-N
Mol Weight 232.3 g/mol
Molecular Formula C12H12N2OS
Exact Mass 232.067034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZscMRPCudv
Name 1-(2-methylallyl)-2-thioxo-quinazolin-4-one
Alternate Name(s) 1-(2-methylprop-2-enyl)-2-sulfanylidene-4-quinazolinone 1-(2-methylprop-2-enyl)-2-sulfanylidene-quinazolin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H12N2OS
InChI InChI=1S/C12H12N2OS/c1-8(2)7-14-10-6-4-3-5-9(10)11(15)13-12(14)16/h3-6H,1,7H2,2H3,(H,13,15,16)
InChIKey YKQKCXRUNWOVRI-UHFFFAOYSA-N
Molecular Weight 232.301 g/mol
SMILES N1C(c2c(N(C1=S)CC(=C)C)cccc2)=O
SPLASH splash10-014i-0090000000-28fb7baae24bd8071f61
Source of Spectrum SO-0-717-10
Wiley ID 877621