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Methyl 13-oxo-14,15,16-trinorlabda-8(17),11E-dien-19-oate
SpectraBase Compound ID ELG2xsSvGtD
InChI InChI=1S/C18H26O3/c1-13-8-9-15-17(2,14(13)7-5-12-19)10-6-11-18(15,3)16(20)21-4/h5,7,12,14-15H,1,6,8-11H2,2-4H3/b7-5+/t14-,15+,17+,18-/m0/s1
InChIKey VJQSYHIAIBRTOX-WIPHFYBHSA-N
Mol Weight 290.4 g/mol
Molecular Formula C18H26O3
Exact Mass 290.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AW1aFqdM0
Name Methyl 13-oxo-14,15,16-trinorlabda-8(17),11E-dien-19-oate
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Formula C18H26O3
InChI InChI=1S/C18H26O3/c1-13-8-9-15-17(2,14(13)7-5-12-19)10-6-11-18(15,3)16(20)21-4/h5,7,12,14-15H,1,6,8-11H2,2-4H3/b7-5+/t14-,15+,17+,18-/m0/s1
InChIKey VJQSYHIAIBRTOX-WIPHFYBHSA-N
Molecular Weight 290.403 g/mol
SMILES [C@@]12([C@]([C@](C(=O)OC)(C)CCC2)(CCC([C@@]1(\C=C\C=O)[H])=C)[H])C
SPLASH splash10-0ac1-7910000000-d312f494ea734a409813
Source of Spectrum E2-50-1627-15
Synonyms (1S,4aS,5S,8aR)-1,4a-dimethyl-6-methylene-5-[(E)-3-oxoprop-1-enyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid methyl ester Methyl (1S,4aS,5S,8aR)-1,4a-dimethyl-6-methylidene-5-[(E)-3-oxoprop-1-enyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate Methyl (1S,4aS,5S,8aR)-1,4a-dimethyl-6-methylene-5-[(E)-3-oxoprop-1-enyl]decalin-1-carboxylate Methyl (1S,4aS,5S,8aR)-1,4a-dimethyl-6-methylidene-5-[(E)-3-oxidanylideneprop-1-enyl]-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
Wiley ID 1555987