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[(1R,3aR,5Z,9E,11R,12aR)-11-acetoxy-1-hydroxy-1-isopropyl-3a,10-dimethyl-2,3,4,7,8,11,12,12a-octahydrocyclopenta[11]annulen-6-yl]methyl acetate

View entire compound with spectra: 1 MS (GC)

[(1R,3aR,5Z,9E,11R,12aR)-11-acetoxy-1-hydroxy-1-isopropyl-3a,10-dimethyl-2,3,4,7,8,11,12,12a-octahydrocyclopenta[11]annulen-6-yl]methyl acetate
SpectraBase Compound ID CGjMtHkIOYH
InChI InChI=1S/C24H38O5/c1-16(2)24(27)13-12-23(6)11-10-20(15-28-18(4)25)9-7-8-17(3)21(14-22(23)24)29-19(5)26/h8,10,16,21-22,27H,7,9,11-15H2,1-6H3/b17-8+,20-10-/t21-,22-,23+,24-/m1/s1
InChIKey KOCINJBLZIFNLK-JTGIECMMSA-N
Mol Weight 406.6 g/mol
Molecular Formula C24H38O5
Exact Mass 406.271924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Vid8BTNhk2
Name [(1R,3aR,5Z,9E,11R,12aR)-11-acetoxy-1-hydroxy-1-isopropyl-3a,10-dimethyl-2,3,4,7,8,11,12,12a-octahydrocyclopenta[11]annulen-6-yl]methyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O5
InChI InChI=1S/C24H38O5/c1-16(2)24(27)13-12-23(6)11-10-20(15-28-18(4)25)9-7-8-17(3)21(14-22(23)24)29-19(5)26/h8,10,16,21-22,27H,7,9,11-15H2,1-6H3/b17-8+,20-10-/t21-,22-,23+,24-/m1/s1
InChIKey KOCINJBLZIFNLK-JTGIECMMSA-N
Molecular Weight 406.563 g/mol
SMILES O[C@@]1([C@]2([C@](CC1)(C\C=C/(COC(=O)C)CC\C=C\([C@@](C2)(OC(=O)C)[H])C)C)[H])C(C)C
SPLASH splash10-002o-0091000000-39b0f8e6bc6647b6ebde
Source of Spectrum F-50-8018-5
Synonyms [(1R,3aR,5Z,9E,11R,12aR)-11-acetyloxy-1-hydroxy-3a,10-dimethyl-1-propan-2-yl-2,3,4,7,8,11,12,12a-octahydrocyclopenta[11]annulen-6-yl]methyl acetate [(1R,3aR,5Z,9E,11R,12aR)-11-acetyloxy-3a,10-dimethyl-1-oxidanyl-1-propan-2-yl-2,3,4,7,8,11,12,12a-octahydrocyclopenta[11]annulen-6-yl]methyl ethanoate Acetic acid [(1R,3aR,5Z,9E,11R,12aR)-11-acetyloxy-1-hydroxy-3a,10-dimethyl-1-propan-2-yl-2,3,4,7,8,11,12,12a-octahydrocyclopenta[11]annulen-6-yl]methyl ester
Wiley ID 1372278