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4-methyl-4-nitrohexanenitrile
SpectraBase Compound ID IpSVuNzXeqS
InChI InChI=1S/C7H12N2O2/c1-3-7(2,9(10)11)5-4-6-8/h3-5H2,1-2H3
InChIKey DEXWSEITJNBBOJ-UHFFFAOYSA-N
Mol Weight 156.19 g/mol
Molecular Formula C7H12N2O2
Exact Mass 156.089878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EbRmV7yba1o
Name 4-METHYL-4-NITROHEXANENITRILE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12N2O2
InChI InChI=1S/C7H12N2O2/c1-3-7(2,9(10)11)5-4-6-8/h3-5H2,1-2H3
InChIKey DEXWSEITJNBBOJ-UHFFFAOYSA-N
Molecular Weight 156.19
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms HEXANENITRILE, 4-METHYL-4-NITRO-,