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3-Benzhydryl-2-phenylbenzo[4,5]imidazo[2,1-b]thiazole
SpectraBase Compound ID CHS1H6jdFnQ
InChI InChI=1S/C28H20N2S/c1-4-12-20(13-5-1)25(21-14-6-2-7-15-21)26-27(22-16-8-3-9-17-22)31-28-29-23-18-10-11-19-24(23)30(26)28/h1-19,25H
InChIKey PNLRGPMHIOUBJC-UHFFFAOYSA-N
Mol Weight 416.54 g/mol
Molecular Formula C28H20N2S
Exact Mass 416.13472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KI4SLIk8n9b
Name 3-Benzhydryl-2-phenylbenzo[4,5]imidazo[2,1-b]thiazole
Appearance White solid
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Formula C28H20N2S
InChI InChI=1S/C28H20N2S/c1-4-12-20(13-5-1)25(21-14-6-2-7-15-21)26-27(22-16-8-3-9-17-22)31-28-29-23-18-10-11-19-24(23)30(26)28/h1-19,25H
InChIKey PNLRGPMHIOUBJC-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200254
Molecular Weight 416.542 g/mol
Reported Formula C28H20N2S
SMILES c1cc2c(cc1)[n]1c(n2)SC(=C1C(c1ccccc1)c1ccccc1)c1ccccc1
SPLASH splash10-014i-0210900000-3f9142d5b4eb5faa639f
Source of Spectrum ASC-364-SM38-4g
Wiley ID 1868528