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4,5,6-TRI-TERT.-BUTYL-2,3-DICYANOBICYCLO-[2.2.0]-HEXA-2,5-DIENE-1-CARBOXYLIC-ACID,TERT.-BUTYLESTER
SpectraBase Compound ID 7ilLk35ealB
InChI InChI=1S/C25H36N2O2/c1-20(2,3)17-18(21(4,5)6)25(22(7,8)9)16(14-27)15(13-26)24(17,25)19(28)29-23(10,11)12/h1-12H3
InChIKey FSCKNFIRUASWKE-UHFFFAOYSA-N
Mol Weight 396.6 g/mol
Molecular Formula C25H36N2O2
Exact Mass 396.277678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 25mpJ7VV4Qp
Name 4,5,6-TRI-TERT.-BUTYL-2,3-DICYANOBICYCLO-[2.2.0]-HEXA-2,5-DIENE-1-CARBOXYLIC-ACID,TERT.-BUTYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36N2O2
InChI InChI=1S/C25H36N2O2/c1-20(2,3)17-18(21(4,5)6)25(22(7,8)9)16(14-27)15(13-26)24(17,25)19(28)29-23(10,11)12/h1-12H3
InChIKey FSCKNFIRUASWKE-UHFFFAOYSA-N
Literature Reference Author H.WINGERT,M.REGITZ
Literature Reference Citation CHEM.BER.,119,244(1986)
Literature Reference DOI 10.1002/cber.19861190122
Molecular Weight 396.573 g/mol
Solvent CDCl3
Source File Reference UWGB1597