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Methyl labda-8(17),11E,13Z-trien-19-oate
SpectraBase Compound ID E6ri799TLBX
InChI InChI=1S/C21H32O2/c1-7-15(2)9-11-17-16(3)10-12-18-20(17,4)13-8-14-21(18,5)19(22)23-6/h7,9,11,17-18H,3,8,10,12-14H2,1-2,4-6H3/b11-9+,15-7-/t17-,18?,20+,21-/m0/s1
InChIKey XJZDZYYGJQYRFG-GRKYXGIISA-N
Mol Weight 316.5 g/mol
Molecular Formula C21H32O2
Exact Mass 316.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9MPj5k2Gx8B
Name Methyl labda-8(17),11E,13Z-trien-19-oate
Alternate Name(s) (1S,4aS,5S)-1,4a-Dimethyl-6-methylene-5-((1E,3Z)-3-methyl-penta-1,3-dienyl)-decahydro-naphthalene-1-carboxylic acid methyl ester Methyl (1S,4aS,5S)-1,4a-dimethyl-6-methylene-5-[(1E,3Z)-3-methyl-1,3-pentadienyl]decahydro-1-naphthalenecarboxylate
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Formula C21H32O2
InChI InChI=1S/C21H32O2/c1-7-15(2)9-11-17-16(3)10-12-18-20(17,4)13-8-14-21(18,5)19(22)23-6/h7,9,11,17-18H,3,8,10,12-14H2,1-2,4-6H3/b11-9+,15-7-/t17-,18?,20+,21-/m0/s1
InChIKey XJZDZYYGJQYRFG-GRKYXGIISA-N
Molecular Weight 316.485 g/mol
SMILES [C@@]12(C([C@](C(=O)OC)(C)CCC2)CCC([C@@]1(\C=C\C(=C/C)C)[H])=C)C
SPLASH splash10-00r6-5913000000-0aa8f211932ed4b3430d
Source of Spectrum AC-1993-705-9
Wiley ID 811628