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2-[1,3]Dithiolol-2-ylidene-6,6-difluoro-5,7-dihydro-5H-[1,3]dithiolo[1,4]dithiepine-4,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID EbA2O4SXAeC
InChI InChI=1S/C13H10F2O4S6/c1-18-7(16)5-6(8(17)19-2)23-11(22-5)12-24-9-10(25-12)21-4-13(14,15)3-20-9/h3-4H2,1-2H3
InChIKey KHJUTAQMKSVRRQ-UHFFFAOYSA-N
Mol Weight 460.6 g/mol
Molecular Formula C13H10F2O4S6
Exact Mass 459.887142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnTC59gkUjf
Name 2-[1,3]Dithiolol-2-ylidene-6,6-difluoro-5,7-dihydro-5H-[1,3]dithiolo[1,4]dithiepine-4,5-dicarboxylic acid dimethyl ester
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Formula C13H10F2O4S6
InChI InChI=1S/C13H10F2O4S6/c1-18-7(16)5-6(8(17)19-2)23-11(22-5)12-24-9-10(25-12)21-4-13(14,15)3-20-9/h3-4H2,1-2H3
InChIKey KHJUTAQMKSVRRQ-UHFFFAOYSA-N
Molecular Weight 460.576 g/mol
SMILES C1(=C(SC(S1)=C1SC=2SCC(CSC2S1)(F)F)C(=O)OC)C(=O)OC
SPLASH splash10-000i-9300500000-d7036f427a57e4f7abfe
Source of Spectrum J-65-6485-7
Synonyms Dimethyl 2-(6,6-difluoro-5,7-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-ylidene)-1,3-dithiole-4,5-dicarboxylate Dimethyl 2-[6,6-bis(fluoranyl)-5,7-dihydro-[1,3]dithiolo[4,5-b][1,4]dithiepin-2-ylidene]-1,3-dithiole-4,5-dicarboxylate
Wiley ID 1533419