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2,3,5,6-Tetrahydro-14H-thioxantheno[2,3-b][1,4,7]trioxonin-14-one
SpectraBase Compound ID 3iWjiK7E7j
InChI InChI=1S/C17H14O4S/c18-17-11-3-1-2-4-15(11)22-16-10-14-13(9-12(16)17)20-7-5-19-6-8-21-14/h1-4,9-10H,5-8H2
InChIKey BTTWCHCIJKQQQP-UHFFFAOYSA-N
Mol Weight 314.36 g/mol
Molecular Formula C17H14O4S
Exact Mass 314.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4U2jK6x6MU
Name 2,3,5,6-Tetrahydro-14H-thioxantheno[2,3-b][1,4,7]trioxonin-14-one
Appearance Yellow crystals
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Formula C17H14O4S
InChI InChI=1S/C17H14O4S/c18-17-11-3-1-2-4-15(11)22-16-10-14-13(9-12(16)17)20-7-5-19-6-8-21-14/h1-4,9-10H,5-8H2
InChIKey BTTWCHCIJKQQQP-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.d01
Molecular Weight 314.355 g/mol
SMILES c12OCCOCCOc2cc2Sc3ccccc3C(c2c1)=O
SPLASH splash10-0a4i-9542000000-d1f9f418175117cb5039
Source of Spectrum ARK-2007-5-3a
Wiley ID 1868826