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12-Desoxy-7-oxopodocarpa-8,11,13-trienoic acid

View entire compound with spectra: 1 MS (GC)

12-Desoxy-7-oxopodocarpa-8,11,13-trienoic acid
SpectraBase Compound ID BXvhZa3KxFl
InChI InChI=1S/C17H20O3/c1-16-8-5-9-17(2,15(19)20)14(16)10-13(18)11-6-3-4-7-12(11)16/h3-4,6-7,14H,5,8-10H2,1-2H3,(H,19,20)/t14-,16-,17+/m1/s1
InChIKey QJOVHZKEWNCUGI-OIISXLGYSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OmAJAD9Gbb
Name 12-Desoxy-7-oxopodocarpa-8,11,13-trienoic acid
Alternate Name(s) (1S,4aS,10aR)-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid (1S,4aS,10aR)-1,4a-dimethyl-9-oxidanylidene-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O3
InChI InChI=1S/C17H20O3/c1-16-8-5-9-17(2,15(19)20)14(16)10-13(18)11-6-3-4-7-12(11)16/h3-4,6-7,14H,5,8-10H2,1-2H3,(H,19,20)/t14-,16-,17+/m1/s1
InChIKey QJOVHZKEWNCUGI-OIISXLGYSA-N
Molecular Weight 272.344 g/mol
SMILES OC([C@@]1([C@]2([C@@](c3ccccc3C(C2)=O)(CCC1)C)[H])C)=O
SPLASH splash10-03di-0090000000-f8b6fb2d440b5493f37a
Source of Spectrum SK-26-4586-11
Wiley ID 867500