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4H-1,4-Benzothiazin-3(2H)-one, 4-benzyl-6-trifluoromethyl-
SpectraBase Compound ID 3cnr4uGzu5N
InChI InChI=1S/C16H12F3NOS/c17-16(18,19)12-6-7-14-13(8-12)20(15(21)10-22-14)9-11-4-2-1-3-5-11/h1-8H,9-10H2
InChIKey PGJBIUICTBVNPZ-UHFFFAOYSA-N
Mol Weight 323.33 g/mol
Molecular Formula C16H12F3NOS
Exact Mass 323.05917 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ltVrFmM8j1
Name 4H-1,4-Benzothiazin-3(2H)-one, 4-benzyl-6-trifluoromethyl-
Alternate Name(s) 4-(Phenylmethyl)-6-(trifluoromethyl)-1,4-benzothiazin-3-one 4-Benzyl-6-(trifluoromethyl)-1,4-benzothiazin-3-one 4-Benzyl-6-(trifluoromethyl)-2H-1,4-benzothiazin-3(4H)-one
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Formula C16H12F3NOS
InChI InChI=1S/C16H12F3NOS/c17-16(18,19)12-6-7-14-13(8-12)20(15(21)10-22-14)9-11-4-2-1-3-5-11/h1-8H,9-10H2
InChIKey PGJBIUICTBVNPZ-UHFFFAOYSA-N
Molecular Weight 323.333 g/mol
SMILES c1ccc(CN2c3cc(C(F)(F)F)ccc3SCC2=O)cc1
SPLASH splash10-0006-9003000000-ecd710714c643fe14050
Source of Spectrum AD-0-2532-0
Wiley ID 1429489