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acetic acid [(4bS)-3-acetoxy-2-isopropyl-10-keto-4b,8,8-trimethyl-6,7-dihydro-5H-phenanthren-4-yl] ester
SpectraBase Compound ID 2zHqH23HJTs
InChI InChI=1S/C24H30O5/c1-13(2)16-11-17-18(27)12-19-23(5,6)9-8-10-24(19,7)20(17)22(29-15(4)26)21(16)28-14(3)25/h11-13H,8-10H2,1-7H3/t24-/m0/s1
InChIKey LYNYOEAYGJKOQZ-DEOSSOPVSA-N
Mol Weight 398.5 g/mol
Molecular Formula C24H30O5
Exact Mass 398.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JApwnsAlGkC
Name acetic acid [(4bS)-3-acetoxy-2-isopropyl-10-keto-4b,8,8-trimethyl-6,7-dihydro-5H-phenanthren-4-yl] ester
Compound Number 101
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H30O5
InChI InChI=1S/C24H30O5/c1-13(2)16-11-17-18(27)12-19-23(5,6)9-8-10-24(19,7)20(17)22(29-15(4)26)21(16)28-14(3)25/h11-13H,8-10H2,1-7H3/t24-/m0/s1
InChIKey LYNYOEAYGJKOQZ-DEOSSOPVSA-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 398.499 g/mol
Solvent CDCl3
Source File Reference UWGE247