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2H-1,3-thiazine-6-carboxylic acid, tetrahydro-4-oxo-3-(phenylmethyl)-2-[[4-(trifluoromethoxy)phenyl]imino]-, (2E)-
SpectraBase Compound ID DbSuBCw5y03
InChI InChI=1S/C19H15F3N2O4S/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 WNDPOWHXYVZJNT-PTGBLXJZSA-N
Mol Weight 424.39 g/mol
Molecular Formula C19H15F3N2O4S
Exact Mass 424.070463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fTpDfsVmTW
Name 3-Benzyl-4-oxo-2-(4-trifluoromethoxy-phenylimino)-[1,3]thiazinane-6-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15F3N2O4S
InChI InChI=1S/C19H15F3N2O4S/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 WNDPOWHXYVZJNT-PTGBLXJZSA-N
Molecular Weight 424.394 g/mol
SMILES OC(C1CC(N(\C(S1)=N/c1ccc(OC(F)(F)F)cc1)Cc1ccccc1)=O)=O
SPLASH splash10-0006-9440300000-0c7a681f80a8e5060748
Synonyms (2E)-3-benzyl-4-oxo-2-{[4-(trifluoromethoxy)phenyl]imino}tetrahydro-2H-1,3-thiazine-6-carboxylic acid
Wiley ID 1447197