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2-(trifluoromethyl)-3,5,6-tris(trifluoromethylthio)-1,4-dithine
SpectraBase Compound ID 7jjyivkQ883
InChI InChI=1S/C8F12S5/c9-5(10,11)1-2(23-6(12,13)14)22-4(25-8(18,19)20)3(21-1)24-7(15,16)17
InChIKey HMAVJNHXKICRKS-UHFFFAOYSA-N
Mol Weight 484.4 g/mol
Molecular Formula C8F12S5
Exact Mass 483.841194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Jc30CsNgrc
Name 2-(trifluoromethyl)-3,5,6-tris(trifluoromethylthio)-1,4-dithine
CAS Registry Number 114885-68-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8F12S5
InChI InChI=1S/C8F12S5/c9-5(10,11)1-2(23-6(12,13)14)22-4(25-8(18,19)20)3(21-1)24-7(15,16)17
InChIKey HMAVJNHXKICRKS-UHFFFAOYSA-N
Molecular Weight 484.369 g/mol
SMILES C1(=C(SC(=C(S1)SC(F)(F)F)SC(F)(F)F)SC(F)(F)F)C(F)(F)F
SPLASH splash10-014i-0000900000-38c89df09ad8e01d4af3
Source of Spectrum K-121-1837-3
Synonyms 2-(trifluoromethyl)-3,5,6-tris[(trifluoromethyl)sulfanyl]-1,4-dithiin
Wiley ID 1395888