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2-Pentafluoroethyl-3-trifluoromethyl-9-thia-1,4a-diazafluoren-4-one
SpectraBase Compound ID Jbvf8oKbqWq
InChI InChI=1S/C13H4F8N2OS/c14-11(15,13(19,20)21)8-7(12(16,17)18)9(24)23-5-3-1-2-4-6(5)25-10(23)22-8/h1-4H
InChIKey VCBCTBIBTWFUHI-UHFFFAOYSA-N
Mol Weight 388.24 g/mol
Molecular Formula C13H4F8N2OS
Exact Mass 387.991659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EEuDxhQBDF6
Name 2-Pentafluoroethyl-3-trifluoromethyl-9-thia-1,4a-diazafluoren-4-one
Alternate Name(s) 2-(1,1,2,2,2-pentafluoroethyl)-3-(trifluoromethyl)-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H4F8N2OS
InChI InChI=1S/C13H4F8N2OS/c14-11(15,13(19,20)21)8-7(12(16,17)18)9(24)23-5-3-1-2-4-6(5)25-10(23)22-8/h1-4H
InChIKey VCBCTBIBTWFUHI-UHFFFAOYSA-N
Molecular Weight 388.235 g/mol
SMILES C1=2Sc3ccccc3N1C(C(=C(N2)C(C(F)(F)F)(F)F)C(F)(F)F)=O
SPLASH splash10-0016-0967000000-ca9c4080f3ea6a6c97a2
Source of Spectrum QC-23-1019-3
Wiley ID 1583936