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3-(isothiocyanatomethyl)tetrahydrothiophene 1,1-dioxide
SpectraBase Compound ID Exd6YSnM8fc
InChI InChI=1S/C6H9NO2S2/c8-11(9)2-1-6(4-11)3-7-5-10/h6H,1-4H2
InChIKey FABOUSHMFZLIPM-UHFFFAOYSA-N
Mol Weight 191.26 g/mol
Molecular Formula C6H9NO2S2
Exact Mass 191.007471 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1TClP19w4gV
Name 3-(isothiocyanatomethyl)tetrahydrothiophene 1,1-dioxide
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/C6H9NO2S2/c8-11(9)2-1-6(4-11)3-7-5-10/h6H,1-4H2
InChIKey FABOUSHMFZLIPM-UHFFFAOYSA-N
NMR Offset 15.3548
NMR Spectrometer Frequency 300.133
Observed nucleus 1H
Origin 1H_SBI_36227_34923
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: E81377; SBI_ID: SBI-034927
Temperature 298 °C