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2H-Cyclobuta[d]phenanthren-1(10H)-one, dodecahydro-6,6,9a-trimethyl-11-methylene-7-(phenylmethoxy)-, (3a.alpha.,5a.beta.,7.alpha.,9a.alpha.,9bR*,11a.alpha.)-(.+-.)-
SpectraBase Compound ID 6y89eolE0Rz
InChI InChI=1S/C27H36O2/c1-18-16-27-20(10-12-21(28)24(18)27)11-13-22-25(2,3)23(14-15-26(22,27)4)29-17-19-8-6-5-7-9-19/h5-9,20,22-24H,1,10-17H2,2-4H3/t20-,22+,23+,24-,26+,27-/m1/s1
InChIKey PVIQXAGQYPZOLE-RSMQFBMUSA-N
Mol Weight 392.6 g/mol
Molecular Formula C27H36O2
Exact Mass 392.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 57hYvBjnJO4
Name 2H-Cyclobuta[d]phenanthren-1(10H)-one, dodecahydro-6,6,9a-trimethyl-11-methylene-7-(phenylmethoxy)-, (3a.alpha.,5a.beta.,7.alpha.,9a.alpha.,9bR*,11a.alpha.)-(.+-.)-
CAS Registry Number 86547-40-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36O2
InChI InChI=1S/C27H36O2/c1-18-16-27-20(10-12-21(28)24(18)27)11-13-22-25(2,3)23(14-15-26(22,27)4)29-17-19-8-6-5-7-9-19/h5-9,20,22-24H,1,10-17H2,2-4H3/t20-,22+,23+,24-,26+,27-/m1/s1
InChIKey PVIQXAGQYPZOLE-RSMQFBMUSA-N
Molecular Weight 392.583 g/mol
SMILES [C@@]123[C@@]4([C@@](C(C)(C)[C@](CC4)(OCc4ccccc4)[H])([H])CC[C@]2(CCC([C@@]3([H])C(C1)=C)=O)[H])C
SPLASH splash10-0006-9520000000-ad00666d5b7738a25bc9
Source of Spectrum H-66-767-0
Synonyms (3aS,5aR,7S,9aS,9bR,11aS)-7-(benzyloxy)-6,6,9a-trimethyl-11-methylenedodecahydro-2H-cyclobuta[d]phenanthren-1(10H)-one 3.beta.-benzyloxy-3'-methylidene-9,11.beta.,3',4',-tetrahydrocyclobuta[1',2':9.alpha.,11]podocarpan-12-one
Wiley ID 1366082