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2-Cyano-6-methoxy-benzobicyclo(2.2.1)heptadiene
SpectraBase Compound ID 1zHZU3X3rar
InChI InChI=1S/C13H11NO/c1-15-10-2-3-11-12-5-8(13(11)6-10)4-9(12)7-14/h2-4,6,8,12H,5H2,1H3/t8-,12-/m0/s1
InChIKey BITCZDUITBYHAA-UFBFGSQYSA-N
Mol Weight 197.24 g/mol
Molecular Formula C13H11NO
Exact Mass 197.084064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HVWEeK6f75D
Name 2-Cyano-6-methoxy-benzobicyclo(2.2.1)heptadiene
CAS Registry Number 71906-42-8
Comments reassigned
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Formula C13H11NO
InChI InChI=1S/C13H11NO/c1-15-10-2-3-11-12-5-8(13(11)6-10)4-9(12)7-14/h2-4,6,8,12H,5H2,1H3/t8-,12-/m0/s1
InChIKey BITCZDUITBYHAA-UFBFGSQYSA-N
Instrument Name Bruker HX-90
Literature Reference A.Y. Ku, L.A. Paquette, M.D. Rozeboom, J. Am. Chem. Soc. 101, 5981 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3