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3,5-DINITRO-p-ANISONITRILE

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3,5-DINITRO-p-ANISONITRILE
SpectraBase Compound ID 9nWD70YAt8h
InChI InChI=1S/C8H5N3O5/c1-16-8-6(10(12)13)2-5(4-9)3-7(8)11(14)15/h2-3H,1H3
InChIKey BZWSSFZXYORCNB-UHFFFAOYSA-N
Mol Weight 223.14 g/mol
Molecular Formula C8H5N3O5
Exact Mass 223.02292 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 25dso8YKmxk
Name 3,5-DINITRO-p-ANISONITRILE
Source of Sample M. P. Simonnin J. Org. Chem. 43, 855(1978)
CAS Registry Number 19018-96-3
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5N3O5
InChI InChI=1S/C8H5N3O5/c1-16-8-6(10(12)13)2-5(4-9)3-7(8)11(14)15/h2-3H,1H3
InChIKey BZWSSFZXYORCNB-UHFFFAOYSA-N
Molecular Weight 223.15
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=304 K Spectrometer= Varian XL-100
Synonyms P-ANISONITRILE, 3,5-DINITRO-,