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1,5-(Ethylmethyl)-2,4,6,8-semibullvalenetetracarboxylic bisimide
SpectraBase Compound ID Lh1MnvBsgng
InChI InChI=1S/C27H20N2O4/c1-3-27-24(2)18-14-25(27)22(32)29(17-12-8-5-9-13-17)23(33)26(25,27)15-19(24)21(31)28(20(18)30)16-10-6-4-7-11-16/h4-15H,3H2,1-2H3/t24-,25-,26+,27+
InChIKey YLRGUAOQHSQIQJ-PVCJUVKBSA-N
Mol Weight 436.47 g/mol
Molecular Formula C27H20N2O4
Exact Mass 436.142307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BYeIaBt5YBp
Name 1,5-(ETHYLMETHYL)-2,4,6,8-SEMIBULLVALENETETRACARBOXYLIC-BISIMIDE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H20N2O4
InChI InChI=1S/C27H20N2O4/c1-3-27-24(2)18-14-25(27)22(32)29(17-12-8-5-9-13-17)23(33)26(25,27)15-19(24)21(31)28(20(18)30)16-10-6-4-7-11-16/h4-15H,3H2,1-2H3/t24-,25-,26+,27+
InChIKey YLRGUAOQHSQIQJ-PVCJUVKBSA-N
Literature Reference Author M.HEUBES,T.DIETZ,H.QUAST,M.SEEFELDER,A.WITZEL,V.R.GADGIL,R.V .WILLIAMS
Literature Reference Citation J.ORG.CHEM.,66,1949(2001)
Literature Reference DOI 10.1021/jo001062a
Molecular Weight 436.467 g/mol
Solvent CDCl3
Source File Reference UWLU26177