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alpha-CHLORO-m-NITROTOLUENE

View entire compound with spectra: 6 NMR, 4 FTIR, 1 Raman, and 2 MS (GC)

alpha-CHLORO-m-NITROTOLUENE
SpectraBase Compound ID GjFMjMjQWrq
InChI InChI=1S/C7H6ClNO2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2
InChIKey APGGSERFJKEWFG-UHFFFAOYSA-N
Mol Weight 171.58 g/mol
Molecular Formula C7H6ClNO2
Exact Mass 171.008706 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FsChbhPi0Me
Name 3-Nitrobenzyl chloride
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 191167
CAS Registry Number 619-23-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6ClNO2
InChI InChI=1S/C7H6ClNO2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2
InChIKey APGGSERFJKEWFG-UHFFFAOYSA-N
Observed nucleus 13C
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-Chloro-3-nitrotoluene
Wiley ID SIAL_13CNMR_002579