For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7-Methanesulfonyl-2,2-bis-trifluoromethyl-2,3-dihydro-9-thia-1,3,4a-triaza-fluoren-4-one
SpectraBase Compound ID FqvvJ9HyeMy
InChI InChI=1S/C12H7F6N3O3S2/c1-26(23,24)5-2-3-6-7(4-5)25-9-20-10(11(13,14)15,12(16,17)18)19-8(22)21(6)9/h2-4H,1H3,(H,19,22)
InChIKey VQLKRIPPBSUUQV-UHFFFAOYSA-N
Mol Weight 419.32 g/mol
Molecular Formula C12H7F6N3O3S2
Exact Mass 418.983302 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 84MKQYn06fi
Name 7-Methanesulfonyl-2,2-bis-trifluoromethyl-2,3-dihydro-9-thia-1,3,4a-triaza-fluoren-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7F6N3O3S2
InChI InChI=1S/C12H7F6N3O3S2/c1-26(23,24)5-2-3-6-7(4-5)25-9-20-10(11(13,14)15,12(16,17)18)19-8(22)21(6)9/h2-4H,1H3,(H,19,22)
InChIKey VQLKRIPPBSUUQV-UHFFFAOYSA-N
Molecular Weight 419.316 g/mol
SMILES N1C(N2c3ccc(cc3SC2=NC1(C(F)(F)F)C(F)(F)F)S(=O)(=O)C)=O
SPLASH splash10-0udi-9525000000-b31fc346f0670376a358
Synonyms 8-(Methylsulfonyl)-2,2-bis(trifluoromethyl)-2,3-dihydro-4H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one 8-Mesyl-2,2-bis(trifluoromethyl)-3H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one 8-Methylsulfonyl-2,2-bis(trifluoromethyl)-3H-[1,3,5]triazino[2,1-b][1,3]benzothiazol-4-one
Wiley ID 1461922