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(+)-(1S,4S,4aR,8aS)-4a,8,8-Trimethyl-3-methylene-4-(3-oxobutyl)decahydro-1-naphthylnyl acetate
SpectraBase Compound ID 99ln5mhkabw
InChI InChI=1S/C20H32O3/c1-13-12-17(23-15(3)22)18-19(4,5)10-7-11-20(18,6)16(13)9-8-14(2)21/h16-18H,1,7-12H2,2-6H3/t16-,17-,18-,20+/m0/s1
InChIKey FRFVAVFESOXLKW-CGBFIWBNSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID As7kQJxs8ze
Name (+)-(1S,4S,4aR,8aS)-4a,8,8-Trimethyl-3-methylene-4-(3-oxobutyl)decahydro-1-naphthylnyl acetate
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Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-13-12-17(23-15(3)22)18-19(4,5)10-7-11-20(18,6)16(13)9-8-14(2)21/h16-18H,1,7-12H2,2-6H3/t16-,17-,18-,20+/m0/s1
InChIKey FRFVAVFESOXLKW-CGBFIWBNSA-N
Molecular Weight 320.473 g/mol
SMILES [C@]12([C@@]([C@@](OC(=O)C)(CC([C@@]2(CCC(=O)C)[H])=C)[H])(C(C)(C)CCC1)[H])C
SPLASH splash10-0w2l-4960000000-bca0fb4f3b6f95f0aedf
Source of Spectrum KC-57-5671-12
Synonyms Acetic acid [(1S,4S,4aR,8aS)-4a,8,8-trimethyl-3-methylene-4-(3-oxobutyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] ester [(1S,4S,4aR,8aS)-4a,8,8-trimethyl-3-methylidene-4-(3-oxobutyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] acetate [(1S,4S,4aR,8aS)-4a,8,8-trimethyl-3-methylene-4-(3-oxobutyl)decalin-1-yl] acetate [(1S,4S,4aR,8aS)-4a,8,8-trimethyl-3-methylidene-4-(3-oxidanylidenebutyl)-2,4,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] ethanoate
Wiley ID 1624854