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2-Methoxycarbonyl-5-methyl-3,4-diphenyltricyclo[4.4.1.1(2,5)]dodeca-3,7,9-trien-12-one
SpectraBase Compound ID FXIBX34QOZG
InChI InChI=1S/C27H24O3/c1-26-20-15-9-10-16-21(17-20)27(24(26)28,25(29)30-2)23(19-13-7-4-8-14-19)22(26)18-11-5-3-6-12-18/h3-16,20-21H,17H2,1-2H3/t20-,21+,26+,27+/m0/s1
InChIKey YIURXPDOBADVGT-ZVMNANPCSA-N
Mol Weight 396.49 g/mol
Molecular Formula C27H24O3
Exact Mass 396.172545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5jHAYRzqVRe
Name 2-METHOXYCARBONYL-5-METHYL-3,4-DIPHENYLTRICYCLO-[4.4.1.1(2,5)]-DODECA-3,7,9-TRIEN-12-ONE
Compound Number 5AG
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H24O3
InChI InChI=1S/C27H24O3/c1-26-20-15-9-10-16-21(17-20)27(24(26)28,25(29)30-2)23(19-13-7-4-8-14-19)22(26)18-11-5-3-6-12-18/h3-16,20-21H,17H2,1-2H3/t20-,21+,26+,27+/m0/s1
InChIKey YIURXPDOBADVGT-ZVMNANPCSA-N
Literature Reference Author T.JIKYO,M.ETO,K.HARANO
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3463(1998)
Literature Reference DOI 10.1039/a804671i
Molecular Weight 396.486 g/mol
Solvent CDCl3