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1-(1-PROPENYL)-2,3,3-TRIFLUORO-2-(PERFLUORO-2-METHYL-3-OXA-5-FLUOROSULPHONYLPENTYLOXY)CYCLOBUTANE (CIS/TRANS MIXTURE)
SpectraBase Compound ID 4zsqQTyYtIH
InChI InChI=1S/C12H8F14O4S/c1-2-3-5-4-6(13,14)7(5,15)29-10(20,21)8(16,9(17,18)19)30-11(22,23)12(24,25)31(26,27)28/h2-3,5H,4H2,1H3/b3-2+
InChIKey KRVQWWDULZGSOS-NSCUHMNNSA-N
Mol Weight 514.23 g/mol
Molecular Formula C12H8F14O4S
Exact Mass 513.991974 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A3YNSkacPWt
Name 1-(1-PROPENYL)-2,3,3-TRIFLUORO-2-(PERFLUORO-2-METHYL-3-OXA-5-FLUOROSULPHONYLPENTYLOXY)CYCLOBUTANE (CIS/TRANS MIXTURE)
Comments REL. INT. OF SIGNALS O-C(CYCLOBUT)-F ARE: 121.4:122.2:140.4:140.7=;RS-56 (RUSSIAN)
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Formula C12H8F14O4S
InChI InChI=1S/C12H8F14O4S/c1-2-3-5-4-6(13,14)7(5,15)29-10(20,21)8(16,9(17,18)19)30-11(22,23)12(24,25)31(26,27)28/h2-3,5H,4H2,1H3/b3-2+
InChIKey KRVQWWDULZGSOS-NSCUHMNNSA-N
Instrument Name SEE COMMENT
Literature Reference A.A.GLAZKOV, A.V.IGNATENKO, S.P.KRUKOVSKY, V.A.PONOMARENKO (1988) Izv.Akad.NaukSSSR(Russ. Lang.): N10, 2372-2377.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6