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Phenylsulfonyl-acetonitrile
SpectraBase Compound ID K0YsHzefhR
InChI InChI=1S/C8H7NO2S/c9-6-7-12(10,11)8-4-2-1-3-5-8/h1-5H,7H2
InChIKey ZFCFFNGBCVAUDE-UHFFFAOYSA-N
Mol Weight 181.21 g/mol
Molecular Formula C8H7NO2S
Exact Mass 181.01975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IMMpQhEgmcy
Name ZFCFFNGBCVAUDE-UHFFFAOYSA-N
Compound Number 7N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7NO2S
InChI InChI=1S/C8H7NO2S/c9-6-7-12(10,11)8-4-2-1-3-5-8/h1-5H,7H2
InChIKey ZFCFFNGBCVAUDE-UHFFFAOYSA-N
Literature Reference Author A.ABBOTTO,S.BRADAMANTE,G.A.PAGANI
Literature Reference Citation J.ORG.CHEM.,58,449(1993)
Literature Reference DOI 10.1021/jo00054a031
Molecular Weight 181.209 g/mol
Solvent CD3OD;C=0.33M
Source File Reference UWCS18728