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2-benzoyl-4-butyl-1,4-benzothiazin-3-one
SpectraBase Compound ID IkmGpbaaIyP
InChI InChI=1S/C19H19NO2S/c1-2-3-13-20-15-11-7-8-12-16(15)23-18(19(20)22)17(21)14-9-5-4-6-10-14/h4-12,18H,2-3,13H2,1H3
InChIKey XBLNFZMCMINUDU-UHFFFAOYSA-N
Mol Weight 325.43 g/mol
Molecular Formula C19H19NO2S
Exact Mass 325.11365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLG3eb9lD87
Name 2-benzoyl-4-butyl-1,4-benzothiazin-3-one
Alternate Name(s) 4-butyl-2-(phenylcarbonyl)-1,4-benzothiazin-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C19H19NO2S
InChI InChI=1S/C19H19NO2S/c1-2-3-13-20-15-11-7-8-12-16(15)23-18(19(20)22)17(21)14-9-5-4-6-10-14/h4-12,18H,2-3,13H2,1H3
InChIKey XBLNFZMCMINUDU-UHFFFAOYSA-N
Molecular Weight 325.426 g/mol
SMILES C1(C(N(CCCC)c2c(S1)cccc2)=O)C(=O)c1ccccc1
SPLASH splash10-0a4i-0904000000-bec7e13d39b3d6543358
Source of Spectrum Y-29-1158-3
Wiley ID 1324015