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Acetic acid, 17-(1,5-dimethylhexyl)-5-hydroxy-10,13-dimethyl-6-oxohexadecahydrocyclopenta[a]phenanthren-3-yl ester
SpectraBase Compound ID C45TNqC9EEd
InChI InChI=1S/C27H46O.C2H4O2/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-25(28)24-11-6-7-15-26(24,4)23(20)14-16-27(21,22)5;1-2(3)4/h18-24H,6-17H2,1-5H3;1H3,(H,3,4)
InChIKey FZFOWQGXGZJQST-UHFFFAOYSA-N
Mol Weight 446.7 g/mol
Molecular Formula C29H50O3
Exact Mass 446.375995 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5grIa8dBV6o
Name ACETIC ACID, 17-(1,5-DIMETHYLHEXYL)-5-HYDROXY-10,13-DIMETHYL-6-OXOHEXADECAHYDROCYCLOPENTA[a]PHENANTHREN-3-YL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C29H48O4
InChI InChI=1S/C27H46O.C2H4O2/c1-18(2)9-8-10-19(3)21-12-13-22-20-17-25(28)24-11-6-7-15-26(24,4)23(20)14-16-27(21,22)5;1-2(3)4/h18-24H,6-17H2,1-5H3;1H3,(H,3,4)
InChIKey FZFOWQGXGZJQST-UHFFFAOYSA-N
Molecular Weight 446.3747
SMILES OC(C)=O.C12CCC3(C)C(CCC3C1CC(=O)C1CCCCC21C)C(CCCC(C)C)C
SPLASH splash10-05mo-9724100000-31e7132541bcad1a9930
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany