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syn-9,18-difluoro-2,11-dithia[3.3]metacyclophane
SpectraBase Compound ID Fxlo36Ji4vs
InChI InChI=1S/C16H14F2S2/c17-15-11-3-1-4-12(15)8-20-10-14-6-2-5-13(16(14)18)9-19-7-11/h1-6H,7-10H2
InChIKey UEUMWJGIQKVNRS-UHFFFAOYSA-N
Mol Weight 308.4 g/mol
Molecular Formula C16H14F2S2
Exact Mass 308.050499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7oO7UH4kkyz
Name syn-9,18-difluoro-2,11-dithia[3.3]metacyclophane
Alternate Name(s) 17,18-difluoro-3,11-dithiatricyclo[11.3.1.1(5,9)]octadeca-1(17),5(18),6,8,13,15-hexaene
CAS Registry Number 106972-81-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14F2S2
InChI InChI=1S/C16H14F2S2/c17-15-11-3-1-4-12(15)8-20-10-14-6-2-5-13(16(14)18)9-19-7-11/h1-6H,7-10H2
InChIKey UEUMWJGIQKVNRS-UHFFFAOYSA-N
Molecular Weight 308.405 g/mol
SMILES c1(c2CSCc3cccc(c3F)CSCc1ccc2)F
SPLASH splash10-05fr-0901000000-5d50a36f2084f8d4ffa5
Source of Spectrum J-54-5878-5
Wiley ID 1309610