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2H-1,3-thiazine-6-carboxylic acid, 2-[[4-(chlorodifluoromethoxy)phenyl]imino]tetrahydro-4-oxo-3-(phenylmethyl)-, (2E)-
SpectraBase Compound ID BA934GZ6qjr
InChI InChI=1S/C19H15ClF2N2O4S/c20-19(21,22)28-14-8-6-13(7-9-14)23-18-24(11-12-4-2-1-3-5-12)16(25)10-15(29-18)17(26)27/h1-9,15H,10-11H2,(H,26,27)/b23-18+
InChIKey BWTNYAHKVFPNFC-PTGBLXJZSA-N
Mol Weight 440.85 g/mol
Molecular Formula C19H15ClF2N2O4S
Exact Mass 440.040912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mG45AHSGHC
Name 3-Benzyl-2-({4-[chloro(difluoro)methoxy]phenyl}imino)-4-oxo-1,3-thiazinane-6-carboxylic acid
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Formula C19H15ClF2N2O4S
InChI InChI=1S/C19H15ClF2N2O4S/c20-19(21,22)28-14-8-6-13(7-9-14)23-18-24(11-12-4-2-1-3-5-12)16(25)10-15(29-18)17(26)27/h1-9,15H,10-11H2,(H,26,27)/b23-18+
InChIKey BWTNYAHKVFPNFC-PTGBLXJZSA-N
Molecular Weight 440.849 g/mol
SMILES OC(C1CC(N(\C(S1)=N/c1ccc(OC(F)(F)Cl)cc1)Cc1ccccc1)=O)=O
SPLASH splash10-0006-9622100000-c7c80bbbbe5b5a6e81e6
Synonyms (2E)-3-benzyl-2-({4-[chloro(difluoro)methoxy]phenyl}imino)-4-oxotetrahydro-2H-1,3-thiazine-6-carboxylic acid
Wiley ID 1463474