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2,4-Diaminobenzo[4,5]thieno[3,2-d]pyrimidine 5,5-dioxide
SpectraBase Compound ID 5vWV9wXJOMt
InChI InChI=1S/C10H8N4O2S/c11-9-8-7(13-10(12)14-9)5-3-1-2-4-6(5)17(8,15)16/h1-4H,(H4,11,12,13,14)
InChIKey UMSRGQSYEKQOJI-UHFFFAOYSA-N
Mol Weight 248.26 g/mol
Molecular Formula C10H8N4O2S
Exact Mass 248.036797 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ywJIfyJozp
Name 2,4-Diaminobenzo[4,5]thieno[3,2-d]pyrimidine 5,5-dioxide
Appearance Pale yellow needles
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Formula C10H8N4O2S
InChI InChI=1S/C10H8N4O2S/c11-9-8-7(13-10(12)14-9)5-3-1-2-4-6(5)17(8,15)16/h1-4H,(H4,11,12,13,14)
InChIKey UMSRGQSYEKQOJI-UHFFFAOYSA-N
Instrument Name JOEL DX-303
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.8.28
Molecular Weight 248.260 g/mol
Reported Formula C10H8N4O2S
SMILES Nc1nc2-c3ccccc3S(c2c(n1)N)(=O)=O
SPLASH splash10-0002-0190000000-1c0e461d0341bdc3c4c7
Source of Spectrum BJO-8-272-3b
Wiley ID 1867351