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6-tert-butyl-2,4-dinitro-3-methylanisole

View entire compound with spectra: 3 NMR, 3 FTIR, and 7 MS (GC)

6-tert-butyl-2,4-dinitro-3-methylanisole
SpectraBase Compound ID GTOFSv3RbNJ
InChI InChI=1S/C12H16N2O5/c1-7-9(13(15)16)6-8(12(2,3)4)11(19-5)10(7)14(17)18/h6H,1-5H3
InChIKey SUAUILGSCPYJCS-UHFFFAOYSA-N
Mol Weight 268.27 g/mol
Molecular Formula C12H16N2O5
Exact Mass 268.105922 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AT0awfe8WHQ
Name 6-tert-BUTYL-2,4-DINITRO-3-METHYLANISOLE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N2O5
InChI InChI=1S/C12H16N2O5/c1-7-9(13(15)16)6-8(12(2,3)4)11(19-5)10(7)14(17)18/h6H,1-5H3
InChIKey SUAUILGSCPYJCS-UHFFFAOYSA-N
Molecular Weight 268.27
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ANISOLE, 2-tert-BUTYL-4,6-DINITRO- 5-METHYL-,