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6,7-DICYANO-4-(2-ETHYL-1-PHENYL-3-ISOUREIDO)-2,3,3A,7A-TETRAHYDRO-2,2-DIMETHYLBENZOFURANE-3A-CARBOXYLIC-ACID,ETHYLESTER
SpectraBase Compound ID BlX3GwKOLi8
InChI InChI=1S/C24H26N4O4/c1-5-30-21(29)24-15-23(3,4)32-20(24)18(14-26)16(13-25)12-19(24)28-22(31-6-2)27-17-10-8-7-9-11-17/h7-12,20H,5-6,15H2,1-4H3,(H,27,28)
InChIKey BDCDNIRJACFNED-UHFFFAOYSA-N
Mol Weight 434.5 g/mol
Molecular Formula C24H26N4O4
Exact Mass 434.195405 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2lUxVcG12bW
Name 6,7-DICYANO-4-(2-ETHYL-1-PHENYL-3-ISOUREIDO)-2,3,3A,7A-TETRAHYDRO-2,2-DIMETHYLBENZOFURANE-3A-CARBOXYLIC-ACID,ETHYLESTER
CAS Registry Number 115483-87-9
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H26N4O4
InChI InChI=1S/C24H26N4O4/c1-5-30-21(29)24-15-23(3,4)32-20(24)18(14-26)16(13-25)12-19(24)28-22(31-6-2)27-17-10-8-7-9-11-17/h7-12,20H,5-6,15H2,1-4H3,(H,27,28)
InChIKey BDCDNIRJACFNED-UHFFFAOYSA-N
Literature Reference Author H.WAMHOFF,F.J.FASSBENDER,M.NIEGER
Literature Reference Citation CHEM.BER.,121,2157(1988)
Literature Reference DOI 10.1002/cber.19881211214
Molecular Weight 434.495 g/mol
Solvent CDCl3
Source File Reference UWGB1708