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Isophthalonitrile

View entire compound with spectra: 23 NMR, 6 FTIR, 1 Raman, and 3 MS (GC)

Isophthalonitrile
SpectraBase Compound ID IL9ck6k9FJ2
InChI InChI=1S/C8H4N2/c9-5-7-2-1-3-8(4-7)6-10/h1-4H
InChIKey LAQPNDIUHRHNCV-UHFFFAOYSA-N
Mol Weight 128.13 g/mol
Molecular Formula C8H4N2
Exact Mass 128.037448 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1VhLTJNkCWk
Name ISOPHTHALSAEUREDINITRIL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H4N2
InChI InChI=1S/C8H4N2/c9-5-7-2-1-3-8(4-7)6-10/h1-4H
InChIKey LAQPNDIUHRHNCV-UHFFFAOYSA-N
Literature Reference Author R.NEIDLEIN,W.KRAMER,R.LEIDHOLDT
Literature Reference Citation HELV.CHIM.ACTA,66,652(1983)
Literature Reference DOI 10.1002/hlca.19830660227
Molecular Weight 128.133 g/mol
Solvent CDCl3
Source File Reference UNIW9829