John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=7i5dEaBFpYA SpectraBase Spectrum ID=8kk6HZ9mui6

(accessed ).
[1R-(1-BETA,2-BETA,4A-BETA,8A-ALPHA)-3-(DECAHYDRO-1,2,4A,5-TRIMETHYL-5-METHYLEN-1-NAPHTHYL)-METHYL]-2,5-DIMETHOXY-2,5-CYCLOHEXADIEN-1,4-DIONE
SpectraBase Compound ID 7i5dEaBFpYA
InChI InChI=1S/C23H32O4/c1-14-8-7-9-19-22(14,3)11-10-15(2)23(19,4)13-16-20(25)18(26-5)12-17(24)21(16)27-6/h12,15,19H,1,7-11,13H2,2-6H3/t15-,19+,22+,23+/m0/s1
InChIKey CLFBEGTWMQIPNO-OVOQHVDUSA-N
Mol Weight 372.5 g/mol
Molecular Formula C23H32O4
Exact Mass 372.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8kk6HZ9mui6
Name [1R-(1-BETA,2-BETA,4A-BETA,8A-ALPHA)-3-(DECAHYDRO-1,2,4A,5-TRIMETHYL-5-METHYLEN-1-NAPHTHYL)-METHYL]-2,5-DIMETHOXY-2,5-CYCLOHEXADIEN-1,4-DIONE
Compound Number 31A
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H32O4
InChI InChI=1S/C23H32O4/c1-14-8-7-9-19-22(14,3)11-10-15(2)23(19,4)13-16-20(25)18(26-5)12-17(24)21(16)27-6/h12,15,19H,1,7-11,13H2,2-6H3/t15-,19+,22+,23+/m0/s1
InChIKey CLFBEGTWMQIPNO-OVOQHVDUSA-N
Literature Reference Author P.STAHL,L.KISSAU,R.MAZITSCHEK,A.HUWE,P.FURET,A.GIANNIS,H.WAL DMANN
Literature Reference Citation J.AM.CHEM.SOC.,123,11586(2001)
Literature Reference DOI 10.1021/ja011413i
Molecular Weight 372.505 g/mol
Solvent CDCl3
Source File Reference UWLU30708
SpectraBase Batch ID 4QhRZKA8GoE