Debug Info

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_id
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DxuGgHlOAGq
spectrumID
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DxuGgHlOAGq
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Mass Spectrum (GC)
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2,4,4-Triphenyl-4H-benzo[4,5]imidazo[2,1-b][1,3]thiazine
SpectraBase Compound ID 4YEbJKf9lTd
InChI InChI=1S/C28H20N2S/c1-4-12-21(13-5-1)26-20-28(22-14-6-2-7-15-22,23-16-8-3-9-17-23)30-25-19-11-10-18-24(25)29-27(30)31-26/h1-20H
InChIKey JSOWUHHJYDZOHL-UHFFFAOYSA-N
Mol Weight 416.54 g/mol
Molecular Formula C28H20N2S
Exact Mass 416.13472 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DxuGgHlOAGq
Name 2,4,4-Triphenyl-4H-benzo[4,5]imidazo[2,1-b][1,3]thiazine
Appearance White solid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20N2S
InChI InChI=1S/C28H20N2S/c1-4-12-21(13-5-1)26-20-28(22-14-6-2-7-15-22,23-16-8-3-9-17-23)30-25-19-11-10-18-24(25)29-27(30)31-26/h1-20H
InChIKey JSOWUHHJYDZOHL-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202200254
Molecular Weight 416.542 g/mol
Reported Formula C28H20N2S
SMILES c1cc2nc3SC(c4ccccc4)=CC(c4ccccc4)(c4ccccc4)[n]3c2cc1
SPLASH splash10-014i-3225900000-c711be33b3a5c96064fe
Source of Spectrum ASC-364-SM33-3h
Wiley ID 1868508
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