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WUBNJPFBMIXYRM-UHFFFAOYSA-N

View entire compound with spectra: 4 NMR

WUBNJPFBMIXYRM-UHFFFAOYSA-N
SpectraBase Compound ID Dvdoifs0m8U
InChI InChI=1S/C9H9FO2S/c10-9-2-1-7-3-4-13(11,12)6-8(7)5-9/h1-2,5H,3-4,6H2
InChIKey WUBNJPFBMIXYRM-UHFFFAOYSA-N
Mol Weight 200.23 g/mol
Molecular Formula C9H9FO2S
Exact Mass 200.030729 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HpCk03y6S3y
Name 7-Fluoro-isothiochroman-2,2-dioxide
CAS Registry Number 50396-80-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H9FO2S
InChI InChI=1S/C9H9FO2S/c10-9-2-1-7-3-4-13(11,12)6-8(7)5-9/h1-2,5H,3-4,6H2
InChIKey WUBNJPFBMIXYRM-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference W. Adcock, B.D. Gupta, W. Kitching, J. Org. Chem. 41, 1498 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3