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2-phenylsulfinylacetonitrile

View entire compound with spectra: 2 NMR, and 1 MS (GC)

2-phenylsulfinylacetonitrile
SpectraBase Compound ID 5DodPZjaV40
InChI InChI=1S/C8H7NOS/c9-6-7-11(10)8-4-2-1-3-5-8/h1-5H,7H2
InChIKey CLVGMMLZSNSJCO-UHFFFAOYSA-N
Mol Weight 165.21 g/mol
Molecular Formula C8H7NOS
Exact Mass 165.024835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5YTSPmwgk7B
Name 2-phenylsulfinylacetonitrile
Compound Number 6N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H7NOS
InChI InChI=1S/C8H7NOS/c9-6-7-11(10)8-4-2-1-3-5-8/h1-5H,7H2
InChIKey CLVGMMLZSNSJCO-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 165.210 g/mol
Solvent DMSO-D6;C=0.33M
Source File Reference UWCS18726