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2H-1-benzopyran-2-one, 3-[(1,1,2,3,3,3-hexafluoropropyl)thio]-4-hydroxy-
SpectraBase Compound ID B4lOlcwpmvT
InChI InChI=1S/C12H6F6O3S/c13-10(11(14,15)16)12(17,18)22-8-7(19)5-3-1-2-4-6(5)21-9(8)20/h1-4,10,19H
InChIKey CYVJSJILZQKBIU-UHFFFAOYSA-N
Mol Weight 344.23 g/mol
Molecular Formula C12H6F6O3S
Exact Mass 343.994184 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KbQXrNSUfk4
Name 2H-1-benzopyran-2-one, 3-[(1,1,2,3,3,3-hexafluoropropyl)thio]-4-hydroxy-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 343.994184202 u
Formula C12H6F6O3S
InChI InChI=1S/C12H6F6O3S/c13-10(11(14,15)16)12(17,18)22-8-7(19)5-3-1-2-4-6(5)21-9(8)20/h1-4,10,19H
InChIKey CYVJSJILZQKBIU-UHFFFAOYSA-N
Molecular Weight 344.227 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15503
Solvent DMSO-d6
Source Vendor ID: ZI/10036295; Lab Info: SIZ; Lab Number: SIZ-0417002