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3-Methylene-5-((4aS,8aS)-2,5,5,8a-tetramethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-yl)-pentanoic acid methyl ester
SpectraBase Compound ID 8h02105nrNT
InChI InChI=1S/C21H32O3/c1-14(12-19(23)24-6)8-9-16-15(2)17(22)13-18-20(3,4)10-7-11-21(16,18)5/h18H,1,7-13H2,2-6H3/t18-,21+/m0/s1
InChIKey WNSPRAKHWDOKJX-GHTZIAJQSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1xS2nc6IXg
Name 3-Methylene-5-((4aS,8aS)-2,5,5,8a-tetramethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydro-naphthalen-1-yl)-pentanoic acid methyl ester
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Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-14(12-19(23)24-6)8-9-16-15(2)17(22)13-18-20(3,4)10-7-11-21(16,18)5/h18H,1,7-13H2,2-6H3/t18-,21+/m0/s1
InChIKey WNSPRAKHWDOKJX-GHTZIAJQSA-N
Molecular Weight 332.484 g/mol
SMILES C=1([C@@]2([C@@](C(C)(C)CCC2)([H])CC(C1C)=O)C)CCC(CC(=O)OC)=C
SPLASH splash10-001r-1369000000-71b2f51b7040d7b637c8
Source of Spectrum F-59-172-19
Synonyms Methyl 7-oxolabda-8,13(16)-dien-15-oate
Wiley ID 1676694