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4-bromo-3'-(tetrahydro-2H-1,2-thiazin-2-yl)benzophenone, S,S-dioxide

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

4-bromo-3'-(tetrahydro-2H-1,2-thiazin-2-yl)benzophenone, S,S-dioxide
SpectraBase Compound ID ES4W9KUX1df
InChI InChI=1S/C17H16BrNO3S/c18-15-8-6-13(7-9-15)17(20)14-4-3-5-16(12-14)19-10-1-2-11-23(19,21)22/h3-9,12H,1-2,10-11H2
InChIKey OXGDPHKCAIUGEJ-UHFFFAOYSA-N
Mol Weight 394.28 g/mol
Molecular Formula C17H16BrNO3S
Exact Mass 393.003428 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Z4JjbxakKX
Name 4-Bromo-3'-(tetrahydro-2H-1,2-thiazin-2-yl)benzophenone, S,S-dioxide
Comments Computed using HOSE algorithm
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Exact Mass 393.003427550 u
Formula C17H16BrNO3S
InChI InChI=1S/C17H16BrNO3S/c18-15-8-6-13(7-9-15)17(20)14-4-3-5-16(12-14)19-10-1-2-11-23(19,21)22/h3-9,12H,1-2,10-11H2
InChIKey OXGDPHKCAIUGEJ-UHFFFAOYSA-N
Molecular Weight 394.283 g/mol
SMILES C=1C(=CC=CC1N1S(CCCC1)(=O)=O)C(C=1C=CC(=CC1)Br)=O