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1,2,5-TRI(METHYLTHIO)-3,6-DIFLUOROBENZENE
SpectraBase Compound ID DB82qeS4DdP
InChI InChI=1S/C9H10F2S3/c1-12-6-4-5(10)8(13-2)9(14-3)7(6)11/h4H,1-3H3
InChIKey XNQGZTPKHAWETP-UHFFFAOYSA-N
Mol Weight 252.36 g/mol
Molecular Formula C9H10F2S3
Exact Mass 251.99127 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LTdHxwTajPk
Name 1,2,5-TRI(METHYLTHIO)-3,6-DIFLUOROBENZENE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H10F2S3
InChI InChI=1S/C9H10F2S3/c1-12-6-4-5(10)8(13-2)9(14-3)7(6)11/h4H,1-3H3
InChIKey XNQGZTPKHAWETP-UHFFFAOYSA-N
Instrument Name Varian A56/60A
Literature Reference M.E.PEACH, A.M.SMITH (1974) J.Fluor.Chem.: v.4, N4, 399-408.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4 carbon tetrachl