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Methyl ent-8beta,13-dihydroxy-14,15,16,20-tetranorlabdan-19-oate
SpectraBase Compound ID Dcu9UeohT3l
InChI InChI=1S/C17H30O4/c1-16-9-5-10-17(2,15(20)21-3)14(16)8-7-13(19)12(16)6-4-11-18/h12-14,18-19H,4-11H2,1-3H3/t12-,13+,14+,16+,17-/m1/s1
InChIKey WPVZSBWNBKARRV-UAHISNFZSA-N
Mol Weight 298.42 g/mol
Molecular Formula C17H30O4
Exact Mass 298.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3calaC8Sv2
Name Methyl ent-8beta,13-dihydroxy-14,15,16,20-tetranorlabdan-19-oate
Alternate Name(s) Methyl (1R,4aR,5S,6S,8aS)-6-hydroxy-5-(3-hydroxypropyl)-1,4a-dimethyldecahydronaphthalene-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O4
InChI InChI=1S/C17H30O4/c1-16-9-5-10-17(2,15(20)21-3)14(16)8-7-13(19)12(16)6-4-11-18/h12-14,18-19H,4-11H2,1-3H3/t12-,13+,14+,16+,17-/m1/s1
InChIKey WPVZSBWNBKARRV-UAHISNFZSA-N
Literature Reference DOI 10.1002/hlca.19800630721
Molecular Weight 298.423 g/mol
SMILES OCCC[C@]1([C@]2([C@](CC[C@@]1(O)[H])([C@@](CCC2)(C(OC)=O)C)[H])C)[H]
SPLASH splash10-0ab9-4970000000-4fa352fdab46454e35d7
Source of Spectrum H-63-1942-30
Wiley ID 1797503