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3-Methyl-6-oxo-2,5-diphenyl-6H-1,3-thiazin-3-ium-4-olate
SpectraBase Compound ID CCHc5QVuRlQ
InChI InChI=1S/C17H13NO2S/c1-18-15(19)14(12-8-4-2-5-9-12)17(20)21-16(18)13-10-6-3-7-11-13/h2-11H,1H3
InChIKey DXESUSSVTJBOET-UHFFFAOYSA-N
Mol Weight 295.36 g/mol
Molecular Formula C17H13NO2S
Exact Mass 295.0667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LzcmtcdNt3
Name 3-Methyl-6-oxo-2,5-diphenyl-6H-1,3-thiazin-3-ium-4-olate
CAS Registry Number 112423-02-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO2S
InChI InChI=1S/C17H13NO2S/c1-18-15(19)14(12-8-4-2-5-9-12)17(20)21-16(18)13-10-6-3-7-11-13/h2-11H,1H3
InChIKey DXESUSSVTJBOET-UHFFFAOYSA-N
Molecular Weight 295.356 g/mol
SMILES C=1([N+](=C(SC(C1c1ccccc1)=O)c1ccccc1)C)[O-]
SPLASH splash10-014i-5920000000-57ee43cc143384451ec9
Source of Spectrum K-121-955-19
Wiley ID 1298222