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4-Nitropentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15,17,19-nonaene
SpectraBase Compound ID 8E9dS1GjCOi
InChI InChI=1S/C20H13NO2/c22-21(23)12-9-10-17-18(11-12)20-15-7-3-1-5-13(15)19(17)14-6-2-4-8-16(14)20/h1-11,19-20H/t19-,20+
InChIKey LMWPOPDXLNHLPY-BGYRXZFFSA-N
Mol Weight 299.33 g/mol
Molecular Formula C20H13NO2
Exact Mass 299.094629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9tqvo21RJ0z
Name 2-NITROTRIPTICENE
Comments P
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Formula C20H13NO2
InChI InChI=1S/C20H13NO2/c22-21(23)12-9-10-17-18(11-12)20-15-7-3-1-5-13(15)19(17)14-6-2-4-8-16(14)20/h1-11,19-20H/t19-,20+
InChIKey LMWPOPDXLNHLPY-BGYRXZFFSA-N
Instrument Name Varian FT-80
Literature Reference G.A.SEREDA, A.A.BORISENKO, V.L.LAPTEVA, V.R.SKVARCHENKO (1992)Zhurn.Org.Khim.(Russ. Lang.): v.28, N6, 1105-1119.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d