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1-[(E)-but-2-enyl]-2-sulfanylidene-4-quinazolinone
SpectraBase Compound ID CB2JTTWv0gc
InChI InChI=1S/C12H12N2OS/c1-2-3-8-14-10-7-5-4-6-9(10)11(15)13-12(14)16/h2-7H,8H2,1H3,(H,13,15,16)/b3-2+
InChIKey KVVMYHQRPPJYID-NSCUHMNNSA-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 Io6p5QmgWvi
Name 1-[(E)-but-2-enyl]-2-sulfanylidene-4-quinazolinone
Comments Less than 3 mono-isotopic peaks
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Formula C12H12N2OS
InChI InChI=1S/C12H12N2OS/c1-2-3-8-14-10-7-5-4-6-9(10)11(15)13-12(14)16/h2-7H,8H2,1H3,(H,13,15,16)/b3-2+
InChIKey KVVMYHQRPPJYID-NSCUHMNNSA-N
Molecular Weight 232.301 g/mol
SMILES N1C(c2c(N(C1=S)C\C=C\C)cccc2)=O
SPLASH splash10-0udi-0090000000-64f0abdf28f92cad8c6a
Source of Spectrum SO-0-717-10
Synonyms 1-[(E)-but-2-enyl]-2-sulfanylidene-quinazolin-4-one 1-[(E)-but-2-enyl]-2-thioxo-quinazolin-4-one
Wiley ID 877620