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2-(3-oxothiomorpholin-2-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
SpectraBase Compound ID 7G7xYLCYw3P
InChI InChI=1S/C13H13F3N2O2S/c14-13(15,16)8-2-1-3-9(6-8)18-11(19)7-10-12(20)17-4-5-21-10/h1-3,6,10H,4-5,7H2,(H,17,20)(H,18,19)
InChIKey UHKOGHPPNDNINL-UHFFFAOYSA-N
Mol Weight 318.31 g/mol
Molecular Formula C13H13F3N2O2S
Exact Mass 318.064983 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHLRVBzOEhK
Name 2-(3-oxothiomorpholin-2-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
Alternate Name(s) 2H-1,4-Thiazine-2-acetamide, tetrahydro-3-oxo-N-[3-(trifluoromethyl)phenyl]- 2-(3-oxo-2-thiomorpholinyl)-N-[3-(trifluoromethyl)phenyl]acetamide 2-(3-oxidanylidenethiomorpholin-2-yl)-N-[3-(trifluoromethyl)phenyl]ethanamide
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Formula C13H13F3N2O2S
InChI InChI=1S/C13H13F3N2O2S/c14-13(15,16)8-2-1-3-9(6-8)18-11(19)7-10-12(20)17-4-5-21-10/h1-3,6,10H,4-5,7H2,(H,17,20)(H,18,19)
InChIKey UHKOGHPPNDNINL-UHFFFAOYSA-N
Molecular Weight 318.314 g/mol
SMILES N(C(CC1C(NCCS1)=O)=O)c1cc(C(F)(F)F)ccc1
SPLASH splash10-0a4i-9800000000-69558c3e3883922f1d0b
Source of Spectrum IY-2-4720-9
Wiley ID 1655192