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2-Cyanoethyl-phenylsulphonyl-acetonitrile

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2-Cyanoethyl-phenylsulphonyl-acetonitrile
SpectraBase Compound ID 6EH7rJCXdTn
InChI InChI=1S/C14H13N3O2S/c15-10-4-8-14(12-17,9-5-11-16)20(18,19)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-9H2
InChIKey DWRFEMIGWMSIRR-UHFFFAOYSA-N
Mol Weight 287.34 g/mol
Molecular Formula C14H13N3O2S
Exact Mass 287.072848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FGHLFL22cfO
Name 2-Cyanoethyl-phenylsulphonyl-acetonitrile
CAS Registry Number 34130-15-9
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H13N3O2S
InChI InChI=1S/C14H13N3O2S/c15-10-4-8-14(12-17,9-5-11-16)20(18,19)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-9H2
InChIKey DWRFEMIGWMSIRR-UHFFFAOYSA-N
Literature Reference A.J. Bellamy, J.B. Kerr, C.J. McGregor, J. Chem. Soc. Perkin II 161 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6