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2-[3'-[3''-(3'''-METHYL-2'''-(PROPYLOXY)-BENZYL)-2''-(PROPYLOXY)-BENZYL]-2'-(PROPYLOXY)-BENZYL]-3-(PROPYLOXY)-PHENANTHRENE

View entire compound with spectra: 1 NMR

2-[3'-[3''-(3'''-METHYL-2'''-(PROPYLOXY)-BENZYL)-2''-(PROPYLOXY)-BENZYL]-2'-(PROPYLOXY)-BENZYL]-3-(PROPYLOXY)-PHENANTHRENE
SpectraBase Compound ID 3jlvuIKyW0e
InChI InChI=1S/2C48H54O4/c2*1-6-25-49-45-33-44-36(24-23-35-16-10-11-22-43(35)44)29-42(45)32-41-21-14-20-40(48(41)52-28-9-4)31-39-19-13-18-38(47(39)51-27-8-3)30-37-17-12-15-34(5)46(37)50-26-7-2/h2*10-24,29,33H,6-9,25-28,30-32H2,1-5H3
InChIKey GXVGJKZFFGNGIT-UHFFFAOYSA-N
Mol Weight 1389.9 g/mol
Molecular Formula C96H108O8
Exact Mass 1388.80442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2fyxX4qa7KW
Name 2-[3'-[3''-(3'''-METHYL-2'''-(PROPYLOXY)-BENZYL)-2''-(PROPYLOXY)-BENZYL]-2'-(PROPYLOXY)-BENZYL]-3-(PROPYLOXY)-PHENANTHRENE
Compound Number 14A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C96H108O8
InChI InChI=1S/2C48H54O4/c2*1-6-25-49-45-33-44-36(24-23-35-16-10-11-22-43(35)44)29-42(45)32-41-21-14-20-40(48(41)52-28-9-4)31-39-19-13-18-38(47(39)51-27-8-3)30-37-17-12-15-34(5)46(37)50-26-7-2/h2*10-24,29,33H,6-9,25-28,30-32H2,1-5H3
InChIKey GXVGJKZFFGNGIT-UHFFFAOYSA-N
Literature Reference Author M.MASTALERZ,W.HUEGGENBERG,G.DYKER
Literature Reference Citation EUR.J.ORG.CHEM.,3977(2006)
Molecular Weight 1389.909 g/mol
Sample ID 44655
Solvent CDCl3