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2-Nitro-alpha-toluenesulfonyl chloride

View entire compound with spectra: 3 NMR, and 2 FTIR

2-Nitro-alpha-toluenesulfonyl chloride
SpectraBase Compound ID Gx5mbEX4Gc8
InChI InChI=1S/C7H6ClNO4S/c8-14(12,13)5-6-3-1-2-4-7(6)9(10)11/h1-4H,5H2
InChIKey FUEFNUGYRWQHTH-UHFFFAOYSA-N
Mol Weight 235.64 g/mol
Molecular Formula C7H6ClNO4S
Exact Mass 234.970607 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID yfY0iz5sjt
Name 2-Nitro-alpha-toluenesulfonyl chloride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 375829
CAS Registry Number 24974-75-2
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6ClNO4S
InChI InChI=1S/C7H6ClNO4S/c8-14(12,13)5-6-3-1-2-4-7(6)9(10)11/h1-4H,5H2
InChIKey FUEFNUGYRWQHTH-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_008029