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7-BETA-H-11-BENZOYL-5-ALPHA-HYDROXY-6,6,10,10-TETRAMETHYL-1-(3-METHYL-2-BUTENYL)-TETRACYCLO-[7.3.1.1(3,11)0(3,7)]-TETRADECANE-2,12,14-TRIONE
SpectraBase Compound ID 5aQ0PgS3Csw
InChI InChI=1S/C30H36O5/c1-17(2)12-13-28-15-19-14-20-26(3,4)21(31)16-29(20,23(28)33)25(35)30(24(28)34,27(19,5)6)22(32)18-10-8-7-9-11-18/h7-12,19-21,31H,13-16H2,1-6H3/t19-,20+,21+,28-,29+,30-/m1/s1
InChIKey MREHBZNQOVPNEK-XFISFPRFSA-N
Mol Weight 476.6 g/mol
Molecular Formula C30H36O5
Exact Mass 476.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZFlY3YLvwZ
Name 7-BETA-H-11-BENZOYL-5-ALPHA-HYDROXY-6,6,10,10-TETRAMETHYL-1-(3-METHYL-2-BUTENYL)-TETRACYCLO-[7.3.1.1(3,11)0(3,7)]-TETRADECANE-2,12,14-TRIONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H36O5
InChI InChI=1S/C30H36O5/c1-17(2)12-13-28-15-19-14-20-26(3,4)21(31)16-29(20,23(28)33)25(35)30(24(28)34,27(19,5)6)22(32)18-10-8-7-9-11-18/h7-12,19-21,31H,13-16H2,1-6H3/t19-,20+,21+,28-,29+,30-/m1/s1
InChIKey MREHBZNQOVPNEK-XFISFPRFSA-N
Literature Reference Author F.G.CRUZ,J.S.R.TEIXEIRA
Literature Reference Citation J.BRAZ.CHEM.SOC.,15,504(2004)
Literature Reference DOI 10.1590/s0103-50532004000400010
Molecular Weight 476.613 g/mol
Solvent CDCl3
Source File Reference UWLU7028