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(3AR*,4R*,10AR*)-4-(4'-METHOXYPHENYL)-1-PENTYL-3,3A,4,5,6,8-HEXAHYDROCYCLOPENTA-[D]-NAPHTHALENE-3,8-DIONE
SpectraBase Compound ID FcCi4NXP74B
InChI InChI=1S/C25H28O3/c1-3-4-5-6-18-16-23(27)24-22(17-7-10-21(28-2)11-8-17)12-9-19-15-20(26)13-14-25(18,19)24/h7-8,10-11,13-16,22,24H,3-6,9,12H2,1-2H3/t22-,24-,25-/m1/s1
InChIKey KDDZMCUAOILAMY-QLBJFCOMSA-N
Mol Weight 376.5 g/mol
Molecular Formula C25H28O3
Exact Mass 376.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8zi30wsJUIg
Name (3AR*,4R*,10AR*)-4-(4'-METHOXYPHENYL)-1-PENTYL-3,3A,4,5,6,8-HEXAHYDROCYCLOPENTA-[D]-NAPHTHALENE-3,8-DIONE
Compound Number 21C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O3
InChI InChI=1S/C25H28O3/c1-3-4-5-6-18-16-23(27)24-22(17-7-10-21(28-2)11-8-17)12-9-19-15-20(26)13-14-25(18,19)24/h7-8,10-11,13-16,22,24H,3-6,9,12H2,1-2H3/t22-,24-,25-/m1/s1
InChIKey KDDZMCUAOILAMY-QLBJFCOMSA-N
Literature Reference Author F.T.BOYLE,O.HARES,Z.S.MATUSIAK,W.LI,D.A.WHITING
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2707(1997)
Literature Reference DOI 10.1039/a702992f
Molecular Weight 376.496 g/mol
Solvent Unknown
Source File Reference UWKP2259