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15-Hydroxypinusolidic acid
SpectraBase Compound ID Elm8h51oqHn
InChI InChI=1S/C20H28O5/c1-12-5-8-15-19(2,9-4-10-20(15,3)18(23)24)14(12)7-6-13-11-16(21)25-17(13)22/h11,14-16,21H,1,4-10H2,2-3H3,(H,23,24)/t14-,15+,16?,19+,20-/m0/s1
InChIKey CKMAUJLOUQNVRZ-QSHLRHACSA-N
Mol Weight 348.44 g/mol
Molecular Formula C20H28O5
Exact Mass 348.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HqjInvD38rj
Name 15-Hydroxypinusolidic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O5
InChI InChI=1S/C20H28O5/c1-12-5-8-15-19(2,9-4-10-20(15,3)18(23)24)14(12)7-6-13-11-16(21)25-17(13)22/h11,14-16,21H,1,4-10H2,2-3H3,(H,23,24)/t14-,15+,16?,19+,20-/m0/s1
InChIKey CKMAUJLOUQNVRZ-QSHLRHACSA-N
Literature Reference DOI 10.1002/jccs.200300022
Molecular Weight 348.439 g/mol
SMILES OC([C@@]1([C@@]2(CCC([C@](CCC=3C(OC(C3)O)=O)([C@]2(CCC1)C)[H])=C)[H])C)=O
SPLASH splash10-00di-0921000000-2f17b95a20373b5f2268
Source of Spectrum QA-50-165-20
Synonyms (1S,4aR,5S,8aR)-5-(2-(5-hydroxy-2-oxo-2,5-dihydrofuran-3-yl)ethyl)-1,4a-dimethyl-6-methylenedecahydronaphthalene-1-carboxylic acid
Wiley ID 1795715