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2-Thioxo-2,3-dihydrobenzo[g]quinazoline-5,10-dione
SpectraBase Compound ID JaH8QPVhwdN
InChI InChI=1S/C12H6N2O2S/c15-10-6-3-1-2-4-7(6)11(16)9-8(10)5-13-12(17)14-9/h1-5H,(H,13,14,17)
InChIKey PPYGVDBMPSZMOY-UHFFFAOYSA-N
Mol Weight 242.25 g/mol
Molecular Formula C12H6N2O2S
Exact Mass 242.014999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrXdNr7bRQR
Name 2-Thioxo-2,3-dihydrobenzo[g]quinazoline-5,10-dione
Appearance Brown powder
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Formula C12H6N2O2S
InChI InChI=1S/C12H6N2O2S/c15-10-6-3-1-2-4-7(6)11(16)9-8(10)5-13-12(17)14-9/h1-5H,(H,13,14,17)
InChIKey PPYGVDBMPSZMOY-UHFFFAOYSA-N
Instrument Name Kratos or Varian MAT 311
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2947
Molecular Weight 242.252 g/mol
SMILES N1C=C2C(=NC1=S)C(c1c(C2=O)cccc1)=O
SPLASH splash10-0udi-9000000000-e5238242bfa47d17d0b8
Source of Spectrum Y-54-3279-4b
Thin-Layer Chromatography Rf = 0.26 (ethyl acetate/pet. ether (40:60), 4:1.5)
Wiley ID 1878649