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[(1S,4bS,10aR)-2-formyl-4b,8,8,10a-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthren-1-yl]methyl acetate
SpectraBase Compound ID 2TnqxpuqDqQ
InChI InChI=1S/C22H34O3/c1-15(24)25-14-17-16(13-23)7-8-19-21(17,4)12-9-18-20(2,3)10-6-11-22(18,19)5/h7,13,17-19H,6,8-12,14H2,1-5H3/t17-,18?,19?,21+,22+/m1/s1
InChIKey JIALFXUXKBYDJT-KCEBLGDVSA-N
Mol Weight 346.5 g/mol
Molecular Formula C22H34O3
Exact Mass 346.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FgkGQtBZCxr
Name [(1S,4bS,10aR)-2-formyl-4b,8,8,10a-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthren-1-yl]methyl acetate
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O3
InChI InChI=1S/C22H34O3/c1-15(24)25-14-17-16(13-23)7-8-19-21(17,4)12-9-18-20(2,3)10-6-11-22(18,19)5/h7,13,17-19H,6,8-12,14H2,1-5H3/t17-,18?,19?,21+,22+/m1/s1
InChIKey JIALFXUXKBYDJT-KCEBLGDVSA-N
Literature Reference Author E.ZUBIA,M.GAVAGNIN,G.SCOGNAMIGLIO,G.CIMINO,G.B.GIUSTO
Literature Reference Citation J.NAT.PROD.,57,725(1994)
Literature Reference DOI 10.1021/np50108a007
Molecular Weight 346.510 g/mol
Solvent Unknown
Source File Reference UWFP25