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SODIUM 1,3,5-TRIS(TRIFLUOROMETHYLSULPHONYL)-4-BUTYLTHIO-2,5-CYCLOHEXADIENE ANION SALT
SpectraBase Compound ID 8JGdkG2n939
InChI InChI=1S/C13H12F9O6S4.Na/c1-2-3-4-29-10-8(31(25,26)12(17,18)19)5-7(30(23,24)11(14,15)16)6-9(10)32(27,28)13(20,21)22;/h5-6,10H,2-4H2,1H3;/q-1;+1
InChIKey VXYIGYUBFCCHHS-UHFFFAOYSA-N
Mol Weight 586.4 g/mol
Molecular Formula C13H12F9NaO6S4
Exact Mass 585.927071 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BJ8y09mMwZE
Name SODIUM 1,3,5-TRIS(TRIFLUOROMETHYLSULPHONYL)-4-BUTYLTHIO-2,5-CYCLOHEXADIENE ANION SALT
Comments NAME DEFINED (A.Y.). SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H12F9NaO6S4
InChI InChI=1S/C13H12F9O6S4.Na/c1-2-3-4-29-10-8(31(25,26)12(17,18)19)5-7(30(23,24)11(14,15)16)6-9(10)32(27,28)13(20,21)22;/h5-6,10H,2-4H2,1H3;/q-1;+1
InChIKey VXYIGYUBFCCHHS-UHFFFAOYSA-N
Instrument Name Tesla BS487
Literature Reference V.N.BOIKO, I.V.IGNAT'EV, G.M.SHCHUPAK, L.M.YAGUPOL'SKY (1979)Zhurn.Org.Khim.(Russ. Lang.): v.15, N4, 806-816.
NMR Standard C6H5CF3
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3H6O acetone