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3-[(1,1,2,3,3,3-hexafluoropropyl)sulfanyl]-4-hydroxy-6-methyl-2H-pyran-2-one
SpectraBase Compound ID DIFMeBRkoY6
InChI InChI=1S/C9H6F6O3S/c1-3-2-4(16)5(6(17)18-3)19-9(14,15)7(10)8(11,12)13/h2,7,16H,1H3
InChIKey QCYHTXABVWADTN-UHFFFAOYSA-N
Mol Weight 308.19 g/mol
Molecular Formula C9H6F6O3S
Exact Mass 307.994184 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FFroKavWIgj
Name 2H-pyran-2-one, 3-[(1,1,2,3,3,3-hexafluoropropyl)thio]-4-hydroxy-6-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.994184202 u
Formula C9H6F6O3S
InChI InChI=1S/C9H6F6O3S/c1-3-2-4(16)5(6(17)18-3)19-9(14,15)7(10)8(11,12)13/h2,7,16H,1H3
InChIKey QCYHTXABVWADTN-UHFFFAOYSA-N
Molecular Weight 308.194 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15531
Solvent DMSO-d6
Source Vendor ID: ZI/10039103; Lab Info: SIZ; Lab Number: SIZ-0417003