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(2S,4aS)-2-hydroxy-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one
SpectraBase Compound ID Ajuh7NqZd4B
InChI InChI=1S/C21H30O3/c1-12(2)13-9-14-15(10-17(13)24-6)21(5)8-7-19(23)20(3,4)18(21)11-16(14)22/h9-10,12,18-19,23H,7-8,11H2,1-6H3/t18?,19-,21+/m0/s1
InChIKey LHADBTRIIHOXKT-IZOREMLJSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LrWrti5BtLg
Name (2S,4aS)-2-hydroxy-6-methoxy-1,1,4a-trimethyl-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one
Compound Number 68
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-12(2)13-9-14-15(10-17(13)24-6)21(5)8-7-19(23)20(3,4)18(21)11-16(14)22/h9-10,12,18-19,23H,7-8,11H2,1-6H3/t18?,19-,21+/m0/s1
InChIKey LHADBTRIIHOXKT-IZOREMLJSA-N
Literature Reference Author J.M.M.DELCORRAL,M.GORDALIZA,M.A.SALINERO,A.SANFELICIANO
Literature Reference Citation MAGN.RES.CHEM.,32,774(1994)
Literature Reference DOI 10.1002/mrc.1260321211
Molecular Weight 330.467 g/mol
Solvent CDCl3
Source File Reference UWGE225