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Bicyclo[10.2.2]hexadeca-4,8-diene-13,15-diol, 1,5,9,13-tetramethyl-, 15-acetate, (1R*,4E,8E,12S*,13S*,15R*)-(+)-
SpectraBase Compound ID 2KLLAu0bB1g
InChI InChI=1S/C22H36O3/c1-16-8-6-9-17(2)11-12-19-14-20(25-18(3)23)21(4,13-7-10-16)15-22(19,5)24/h9-10,19-20,24H,6-8,11-15H2,1-5H3/b16-10+,17-9+/t19-,20+,21+,22-/m0/s1
InChIKey GXXLLEDKYVEOQW-IXTOOIEMSA-N
Mol Weight 348.5 g/mol
Molecular Formula C22H36O3
Exact Mass 348.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoDUfEKttl2
Name Bicyclo[10.2.2]hexadeca-4,8-diene-13,15-diol, 1,5,9,13-tetramethyl-, 15-acetate, (1R*,4E,8E,12S*,13S*,15R*)-(+)-
Alternate Name(s) (1S,12R,13R,15S)-15-hydroxy-4,8,12,15-tetramethylbicyclo[10.2.2]hexadeca-4,8-dien-13-yl acetate 3.alpha.-Acetoxy-15.beta.-hydroxy-7,16-secotrinervita-7,11-diene
CAS Registry Number 76372-20-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H36O3
InChI InChI=1S/C22H36O3/c1-16-8-6-9-17(2)11-12-19-14-20(25-18(3)23)21(4,13-7-10-16)15-22(19,5)24/h9-10,19-20,24H,6-8,11-15H2,1-5H3/b16-10+,17-9+/t19-,20+,21+,22-/m0/s1
InChIKey GXXLLEDKYVEOQW-IXTOOIEMSA-N
Molecular Weight 348.527 g/mol
SMILES O[C@]1(C[C@@]2([C@@](C[C@@]1(CC\C(C)=C\CC\C(=C\CC2)C)[H])(OC(=O)C)[H])C)C
SPLASH splash10-00di-0950000000-9100b2dbfde9550cafb1
Source of Spectrum AN-90-494-0
Wiley ID 1340992