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5,14-DIPHENYL-5,14-DIAZAPENTACYCLO-[9.5.1.0(2,10).0(3,7).0(12,16)]-HEPTADEC-9-ENE-4,6,13,15-TETRONE
SpectraBase Compound ID 22XzNAVDZ2r
InChI InChI=1S/C27H22N2O4/c30-24-17-12-11-16-18-13-19(20(16)21(17)25(31)28(24)14-7-3-1-4-8-14)23-22(18)26(32)29(27(23)33)15-9-5-2-6-10-15/h1-11,17-23H,12-13H2/t17?,18-,19+,20?,21?,22?,23?/m1/s1
InChIKey FSHSWKAISCLBHQ-TWLLVETNSA-N
Mol Weight 438.48 g/mol
Molecular Formula C27H22N2O4
Exact Mass 438.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K62rlDjMZTl
Name 5,14-DIPHENYL-5,14-DIAZAPENTACYCLO-[9.5.1.0(2,10).0(3,7).0(12,16)]-HEPTADEC-9-ENE-4,6,13,15-TETRONE
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H22N2O4
InChI InChI=1S/C27H22N2O4/c30-24-17-12-11-16-18-13-19(20(16)21(17)25(31)28(24)14-7-3-1-4-8-14)23-22(18)26(32)29(27(23)33)15-9-5-2-6-10-15/h1-11,17-23H,12-13H2/t17?,18-,19+,20?,21?,22?,23?/m1/s1
InChIKey FSHSWKAISCLBHQ-TWLLVETNSA-N
Literature Reference Author U.H.BRINKER,I.FLEISCHHAUER
Literature Reference Citation CHEM.BER.,119,1244(1986)
Literature Reference DOI 10.1002/cber.19861190414
Molecular Weight 438.483 g/mol
Solvent CD2Cl2
Source File Reference UWGB1410