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2-(2-Methoxybenzoyl)methylenethiazine
SpectraBase Compound ID DOZfSTBQEWA
InChI InChI=1S/C13H15NO2S/c1-16-12-6-3-2-5-10(12)11(15)9-13-14-7-4-8-17-13/h2-3,5-6,9,14H,4,7-8H2,1H3/b13-9+
InChIKey NLBBBMHTLOJPAD-UKTHLTGXSA-N
Mol Weight 249.33 g/mol
Molecular Formula C13H15NO2S
Exact Mass 249.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID sBvr2Dxkys
Name 2-(2-Methoxybenzoyl)methylenethiazine
Alternate Name(s) (2E)-1-(2-methoxyphenyl)-2-tetrahydro-2H-1,3-thiazin-2-ylideneethanone
Comments Less than 3 mono-isotopic peaks
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Formula C13H15NO2S
InChI InChI=1S/C13H15NO2S/c1-16-12-6-3-2-5-10(12)11(15)9-13-14-7-4-8-17-13/h2-3,5-6,9,14H,4,7-8H2,1H3/b13-9+
InChIKey NLBBBMHTLOJPAD-UKTHLTGXSA-N
Molecular Weight 249.328 g/mol
SMILES N1CCCS\C1=C/C(c1c(OC)cccc1)=O
SPLASH splash10-000i-0900000000-e45c9c39d8628a85098d
Source of Spectrum F-51-1446-2
Wiley ID 790959