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(E)-ethoxy-(3-keto-8,8-diphenyl-6,7-dihydro-5H-thiazolo[3,2-a]pyridin-4-ium-2-ylidene)methanolate
SpectraBase Compound ID JBZZckueZ9q
InChI InChI=1S/C22H21NO3S/c1-2-26-20(25)18-19(24)23-15-9-14-22(21(23)27-18,16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-8,10-13H,2,9,14-15H2,1H3
InChIKey XOICVFMKOOASHL-UHFFFAOYSA-N
Mol Weight 379.47 g/mol
Molecular Formula C22H21NO3S
Exact Mass 379.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bTvKF9lxI
Name (E)-ethoxy-(3-keto-8,8-diphenyl-6,7-dihydro-5H-thiazolo[3,2-a]pyridin-4-ium-2-ylidene)methanolate
Alternate Name(s) (E)-ethoxy-(3-oxidanylidene-8,8-diphenyl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridin-4-ium-2-ylidene)methanolate (E)-ethoxy-(3-oxo-8,8-diphenyl-6,7-dihydro-5H-thiazolo[3,2-a]pyridin-4-ium-2-ylidene)methanolate (E)-ethoxy-(3-oxo-8,8-diphenyl-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyridin-4-ium-2-ylidene)methanolate
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Formula C22H21NO3S
InChI InChI=1S/C22H21NO3S/c1-2-26-20(25)18-19(24)23-15-9-14-22(21(23)27-18,16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-8,10-13H,2,9,14-15H2,1H3
InChIKey XOICVFMKOOASHL-UHFFFAOYSA-N
Molecular Weight 379.474 g/mol
SMILES c12C(CCC[n+]2c(c(s1)C(=O)OCC)[O-])(c1ccccc1)c1ccccc1
SPLASH splash10-0a6r-0339000000-f8d324770b3ad31e50c3
Source of Spectrum K-2001-2061-25
Wiley ID 1579599