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1-(Phenylsulfonyl)-2-pyrrolecarbonitrile

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

1-(Phenylsulfonyl)-2-pyrrolecarbonitrile
SpectraBase Compound ID DXamjV4B3R4
InChI InChI=1S/C11H8N2O2S/c12-9-10-5-4-8-13(10)16(14,15)11-6-2-1-3-7-11/h1-8H
InChIKey XXJCLUNFWADISV-UHFFFAOYSA-N
Mol Weight 232.26 g/mol
Molecular Formula C11H8N2O2S
Exact Mass 232.030649 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8SKVt9N35rh
Name 1-(Phenylsulfonyl)-2-pyrrolecarbonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 438855
CAS Registry Number 97188-22-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N2O2S
InChI InChI=1S/C11H8N2O2S/c12-9-10-5-4-8-13(10)16(14,15)11-6-2-1-3-7-11/h1-8H
InChIKey XXJCLUNFWADISV-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_009624