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7-[(4-nitrophenyl)sulfonyl]-2,2-bis(trifluoromethyl)-2,3-dihydro-4H-[1,3]thiazolo[3,2-a][1,3,5]triazin-4-one
SpectraBase Compound ID 6FZZxFSc7Pt
InChI InChI=1S/C13H6F6N4O5S2/c14-12(15,16)11(13(17,18)19)20-9(24)22-5-8(29-10(22)21-11)30(27,28)7-3-1-6(2-4-7)23(25)26/h1-5H,(H,20,24)
InChIKey MIKWHOHZKMHGTB-UHFFFAOYSA-N
Mol Weight 476.32 g/mol
Molecular Formula C13H6F6N4O5S2
Exact Mass 475.968381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5QA4QRHM3F9
Name 7-(4-nitrophenyl)sulfonyl-2,2-bis(trifluoromethyl)-3H-thiazolo[3,2-a][1,3,5]triazin-4-one
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Formula C13H6F6N4O5S2
InChI InChI=1S/C13H6F6N4O5S2/c14-12(15,16)11(13(17,18)19)20-9(24)22-5-8(29-10(22)21-11)30(27,28)7-3-1-6(2-4-7)23(25)26/h1-5H,(H,20,24)
InChIKey MIKWHOHZKMHGTB-UHFFFAOYSA-N
Molecular Weight 476.324 g/mol
SMILES N1C(N2C=C(SC2=NC1(C(F)(F)F)C(F)(F)F)S(c1ccc(N(=O)=O)cc1)(=O)=O)=O
SPLASH splash10-0a4i-9210100000-fce44c518a55b7c1bf4c
Synonyms 7-(4-nitrophenyl)sulfonyl-2,2-bis(trifluoromethyl)-3H-[1,3]thiazolo[3,2-a][1,3,5]triazin-4-one 7-nosyl-2,2-bis(trifluoromethyl)-3H-thiazolo[3,2-a][1,3,5]triazin-4-one 7-[(4-nitrophenyl)sulfonyl]-2,2-bis(trifluoromethyl)-2,3-dihydro-4H-[1,3]thiazolo[3,2-a][1,3,5]triazin-4-one
Wiley ID 1461923