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5-BENZYL-8A-METHYL-(4B-ALPHA,5-ALPHA,7-ALPHA,8-ALPHA,8A-ALPHA)-2-METHOXY-4-METHYL-6-OXO-4B,5,7,8,9,10-HEXAHYDRO-7,8-METHANOPHENANTHRENE-5,8A(6H)-D
SpectraBase Compound ID 3B11lWQSqhV
InChI InChI=1S/C27H28O6/c1-15-11-18(31-2)12-17-9-10-27(26(30)32-3)20-13-19(20)24(28)22(23(27)21(15)17)25(29)33-14-16-7-5-4-6-8-16/h4-8,11-12,19-20,22-23H,9-10,13-14H2,1-3H3/t19?,20?,22-,23?,27?/m1/s1
InChIKey QUFVFMRCQNTFKM-OHLZAFRYSA-N
Mol Weight 448.52 g/mol
Molecular Formula C27H28O6
Exact Mass 448.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ruCgRWldON
Name 5-BENZYL-8A-METHYL-(4B-ALPHA,5-ALPHA,7-ALPHA,8-ALPHA,8A-ALPHA)-2-METHOXY-4-METHYL-6-OXO-4B,5,7,8,9,10-HEXAHYDRO-7,8-METHANOPHENANTHRENE-5,8A(6H)-D
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H28O6
InChI InChI=1S/C27H28O6/c1-15-11-18(31-2)12-17-9-10-27(26(30)32-3)20-13-19(20)24(28)22(23(27)21(15)17)25(29)33-14-16-7-5-4-6-8-16/h4-8,11-12,19-20,22-23H,9-10,13-14H2,1-3H3/t19?,20?,22-,23?,27?/m1/s1
InChIKey QUFVFMRCQNTFKM-OHLZAFRYSA-N
Literature Reference Author D.H.ROGERS,B.FREY,F.S.RODEN,F.W.RUSSKAMP,A.C.WILLIS,L.N.MAND ER
Literature Reference Citation AUSTR.J.CHEM.,52,1093(1999)
Literature Reference DOI 10.1071/CH99093
Molecular Weight 448.516 g/mol
Solvent Unknown
Source File Reference UWRU5341