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4-Nitrotoluene

View entire compound with spectra: 55 NMR, 6 FTIR, 1 UV-Vis, and 18 MS (GC)

4-Nitrotoluene
SpectraBase Compound ID Is0v2TNiaOj
InChI InChI=1S/C7H7NO2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3
InChIKey ZPTVNYMJQHSSEA-UHFFFAOYSA-N
Mol Weight 137.14 g/mol
Molecular Formula C7H7NO2
Exact Mass 137.047678 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID BRwwShvRjBr
Name 4-Nitrotoluene
Source of Sample Aldrich
Catalog Number N27322
CAS Registry Number 99-99-0
Classification Aromatic nitro and nitroso compounds
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7NO2
InChI InChI=1S/C7H7NO2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3
InChIKey ZPTVNYMJQHSSEA-UHFFFAOYSA-N
Purity 99%
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1-Methyl-4-nitrobenzene
Technique Melt
Wiley ID SIAL_FTIR_1_10457