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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 EqO5K5gl68d
Name 3-[(1,1,2,3,3,3-hexafluoropropyl)sulfanyl]-4-hydroxy-2H-chromen-2-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
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
NMR Offset 18.0614
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_308
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: C27591; Labnumber: AKSIN-0034; SBI_ID: SBI-000310
Temperature 306 °C