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2-Nitrotoluene

View entire compound with spectra: 48 NMR, 13 FTIR, 14 MS (GC), and 2 Near IR

2-Nitrotoluene
SpectraBase Compound ID 2kUit6mEagT
InChI InChI=1S/C7H7NO2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3
InChIKey PLAZTCDQAHEYBI-UHFFFAOYSA-N
Mol Weight 137.14 g/mol
Molecular Formula C7H7NO2
Exact Mass 137.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9LGDQNjQxT3
Name Benzene, 1-methyl-2-nitro-
Alternate Name(s) 1-Methyl-2-nitro-benzene 2-Methyl-1-nitrobenzene 2-Methylnitrobenzene 2-Nitrotoluene 2-Nitrotoluol Nitrotoluene, o- Nitrotoluene, o-isomer o-Methylnitrobenzene O-nitrotoluol ONT Ortho-nitrotoluol Toluene, o-nitro- Toluene,2-nitro AI3-16311 CCRIS 1224 EINECS 201-853-3 HSDB 2189 NSC 9577 O-NITROTOLUENE, LIQUID
CAS Registry Number 88-72-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7NO2
InChI InChI=1S/C7H7NO2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3
InChIKey PLAZTCDQAHEYBI-UHFFFAOYSA-N
Molecular Weight 137.138 g/mol
SMILES c1(N(=O)=O)c(C)cccc1
SPLASH splash10-00y3-9400000000-5f8e6e3264c2c52e1d56
Wiley ID 1492211