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3-(2,4-Dibromophenyl)-2-mercapto-3H-quinazolin-4-one
SpectraBase Compound ID JmyT6BHVMyV
InChI InChI=1S/C14H8Br2N2OS/c15-8-5-6-12(10(16)7-8)18-13(19)9-3-1-2-4-11(9)17-14(18)20/h1-7H,(H,17,20)
InChIKey AIPVJEGVMJPESO-UHFFFAOYSA-N
Mol Weight 412.1 g/mol
Molecular Formula C14H8Br2N2OS
Exact Mass 409.87241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IErIODAg37x
Name 3-(2,4-Dibromophenyl)-2-mercapto-3H-quinazolin-4-one
Alternate Name(s) 3-(2,4-dibromophenyl)-2-sulfanylidene-1H-quinazolin-4-one 3-[2,4-bis(bromanyl)phenyl]-2-sulfanylidene-1H-quinazolin-4-one
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Formula C14H8Br2N2OS
InChI InChI=1S/C14H8Br2N2OS/c15-8-5-6-12(10(16)7-8)18-13(19)9-3-1-2-4-11(9)17-14(18)20/h1-7H,(H,17,20)
InChIKey AIPVJEGVMJPESO-UHFFFAOYSA-N
Molecular Weight 412.099 g/mol
SMILES SC=1N(C(c2c(cccc2)N1)=O)c1c(cc(cc1)Br)Br
SPLASH splash10-001i-0119000000-886e8627f0cd5b476ab5
Source of Spectrum U1-2009-2500-9b
Wiley ID 1662967