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4,5-bis(trifluoromethyl)-1,3-dithiacyclopent-4-en-2-one
SpectraBase Compound ID Gc7JHNhcdsD
InChI InChI=1S/C5F6OS2/c6-4(7,8)1-2(5(9,10)11)14-3(12)13-1
InChIKey DNXOMGSWTDDKSC-UHFFFAOYSA-N
Mol Weight 254.16 g/mol
Molecular Formula C5F6OS2
Exact Mass 253.929476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8aqvn3ontOt
Name 4,5-bis(trifluoromethyl)-1,3-dithiacyclopent-4-en-2-one
CAS Registry Number 133816-24-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5F6OS2
InChI InChI=1S/C5F6OS2/c6-4(7,8)1-2(5(9,10)11)14-3(12)13-1
InChIKey DNXOMGSWTDDKSC-UHFFFAOYSA-N
Molecular Weight 254.164 g/mol
SMILES C1(=C(SC(S1)=O)C(F)(F)F)C(F)(F)F
SPLASH splash10-0ik9-0960000000-d7576ec605d0513b4b35
Source of Spectrum K-124-2029-7
Synonyms 4,5-bis(trifluoromethyl)-1,3-dithiol-2-one
Wiley ID 1257071