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3,4-Dimethyl-5-nitrobenzonitrile
SpectraBase Compound ID IlOxpzSi2GP
InChI InChI=1S/C9H8N2O2/c1-6-3-8(5-10)4-9(7(6)2)11(12)13/h3-4H,1-2H3
InChIKey SARRHHOGHADAJU-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C9H8N2O2
Exact Mass 176.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LnJTkeOLsaT
Name 3,4-Dimethyl-5-nitrobenzonitrile
Alternate Name(s) 3,4-Dimethyl-5-nitro-benzenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2O2
InChI InChI=1S/C9H8N2O2/c1-6-3-8(5-10)4-9(7(6)2)11(12)13/h3-4H,1-2H3
InChIKey SARRHHOGHADAJU-UHFFFAOYSA-N
Molecular Weight 176.175 g/mol
SMILES c1(N(=O)=O)c(c(C)cc(C#N)c1)C
SPLASH splash10-08fr-1900000000-642bb019f2a2e4accbbd
Source of Spectrum KC-1983-1005-0
Wiley ID 1172087