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3-Nitrotoluene

View entire compound with spectra: 21 NMR, 9 FTIR, 1 UV-Vis, 13 MS (GC), and 2 Near IR

3-Nitrotoluene
SpectraBase Compound ID DruJ93opRIe
InChI InChI=1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3
InChIKey QZYHIOPPLUPUJF-UHFFFAOYSA-N
Mol Weight 137.14 g/mol
Molecular Formula C7H7NO2
Exact Mass 137.047678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gsv1AJMSo
Name 3-Nitro-toluene
CAS Registry Number 99-08-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H7NO2
InChI InChI=1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3
InChIKey QZYHIOPPLUPUJF-UHFFFAOYSA-N
Instrument Name Jeol PFT-100
Literature Reference J. Bromilow, R.T. Brownlee, D.J. Craik, M.Sadek, Magn. Res. Chem. 24, 862 (1986)
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3