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tetrahydro-2-thiophenecarbonitrile, 1,1-dioxide
SpectraBase Compound ID DeEui3tWc2T
InChI InChI=1S/C5H7NO2S/c6-4-5-2-1-3-9(5,7)8/h5H,1-3H2
InChIKey HWIMUILMAKIPFO-UHFFFAOYSA-N
Mol Weight 145.18 g/mol
Molecular Formula C5H7NO2S
Exact Mass 145.01975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 75eKyKbRBOa
Name TETRAHYDRO-2-THIOPHENECARBONITRILE, 1,1-DIOXIDE
Source of Sample J. T. Wrobel and E. Hejchman, Warsaw University, Warsaw, Poland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H7NO2S
InChI InChI=1S/C5H7NO2S/c6-4-5-2-1-3-9(5,7)8/h5H,1-3H2
InChIKey HWIMUILMAKIPFO-UHFFFAOYSA-N
Melting Point 47-48C
Molecular Weight 145.18
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms 2-THIOPHENECARBONITRILE, TETRAHYDRO-, 1,1-DIOXIDE