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15,16-Bisnor-13-oxo-8(17),11E-labdadien-19-oic acid
SpectraBase Compound ID 8rvhOqgXs2b
InChI InChI=1S/C18H26O3/c1-12-6-9-15-17(3,14(12)8-7-13(2)19)10-5-11-18(15,4)16(20)21/h7-8,14-15H,1,5-6,9-11H2,2-4H3,(H,20,21)/b8-7+/t14-,15+,17+,18-/m0/s1
InChIKey BQLIBSZGTNAGNT-OQOGXPRXSA-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 Dzqu8Y4iIEq
Name 15,16-Bisnor-13-oxo-8(17),11E-labdadien-19-oic acid
Alternate Name(s) (1S,4aS,5S,8aR)-1,4a-dimethyl-6-methylene-5-((E)-3-oxobut-1-en-1-yl)decahydronaphthalene-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O3
InChI InChI=1S/C18H26O3/c1-12-6-9-15-17(3,14(12)8-7-13(2)19)10-5-11-18(15,4)16(20)21/h7-8,14-15H,1,5-6,9-11H2,2-4H3,(H,20,21)/b8-7+/t14-,15+,17+,18-/m0/s1
InChIKey BQLIBSZGTNAGNT-OQOGXPRXSA-N
Literature Reference DOI 10.1002/jccs.200300022
Molecular Weight 290.403 g/mol
SMILES OC([C@]1(CCC[C@@]2([C@](C(CC[C@@]12[H])=C)(\C=C\C(=O)C)[H])C)C)=O
SPLASH splash10-05gi-4930000000-16e3db9ef49cad0aea9d
Source of Spectrum QA-50-164-11
Wiley ID 1795709