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4-Oxo-4H-[1]benzothieno[3,2-b]thiopyran-3-carbaldoxime -
SpectraBase Compound ID FnOE7qs2vnl
InChI InChI=1S/C12H7NO2S2/c14-10-7(5-13-15)6-16-11-8-3-1-2-4-9(8)17-12(10)11/h1-6,15H/b13-5+
InChIKey BVAHCGPOKVMICS-WLRTZDKTSA-N
Mol Weight 261.31 g/mol
Molecular Formula C12H7NO2S2
Exact Mass 260.991821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsbSlslcqyG
Name 4-Oxo-4H-[1]benzothieno[3,2-b]thiopyran-3-carbaldoxime -
Comments Less than 3 mono-isotopic peaks
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Formula C12H7NO2S2
InChI InChI=1S/C12H7NO2S2/c14-10-7(5-13-15)6-16-11-8-3-1-2-4-9(8)17-12(10)11/h1-6,15H/b13-5+
InChIKey BVAHCGPOKVMICS-WLRTZDKTSA-N
Molecular Weight 261.313 g/mol
SMILES O\N=C\C=1C(c2c(SC1)c1ccccc1s2)=O
SPLASH splash10-0f6x-0090000000-947bc410affe8f4e9675
Source of Spectrum D8-323-845-7
Synonyms (3E)-4-oxo-3-thiopyrano[3,2-b][1]benzothiolecarboxaldehyde oxime (3E)-4-oxothiopyrano[3,2-b]benzothiophene-3-carbaldehyde oxime 3-[(E)-hydroxyiminomethyl]thiopyrano[3,2-b][1]benzothiol-4-one
Wiley ID 1513810