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anthra[1,2-b]benzothiophene
SpectraBase Compound ID AqHk6XwcTRQ
InChI InChI=1S/C20H12S/c1-2-6-14-12-18-15(11-13(14)5-1)9-10-17-16-7-3-4-8-19(16)21-20(17)18/h1-12H
InChIKey PNOLZEWNRDUVGV-UHFFFAOYSA-N
Mol Weight 284.38 g/mol
Molecular Formula C20H12S
Exact Mass 284.065972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GodklHkHTFm
Name anthra[1,2-b]benzothiophene
CAS Registry Number 223-47-2
Comments Less than 3 mono-isotopic peaks
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Formula C20H12S
InChI InChI=1S/C20H12S/c1-2-6-14-12-18-15(11-13(14)5-1)9-10-17-16-7-3-4-8-19(16)21-20(17)18/h1-12H
InChIKey PNOLZEWNRDUVGV-UHFFFAOYSA-N
Molecular Weight 284.376 g/mol
SMILES c12sc3ccccc3c2ccc2c1cc1ccccc1c2
SPLASH splash10-001i-0090000000-76ddd0014bdc329d1a64
Source of Spectrum Y-20-866-0
Synonyms anthra[1,2-b][1]benzothiole
Wiley ID 1288519