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Methyl 13-hydroxy-14-oxo-labd-8(17)-en-19-oate
SpectraBase Compound ID Jy7pn1B1l1A
InChI InChI=1S/C21H34O4/c1-14-8-9-17-19(3,11-7-12-20(17,4)18(23)25-6)16(14)10-13-21(5,24)15(2)22/h16-17,24H,1,7-13H2,2-6H3/t16-,17?,19+,20-,21?/m0/s1
InChIKey AWHUAASAHJWMRQ-HJUTVMMFSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jVagZVWYHy
Name Methyl 13-hydroxy-14-oxo-labd-8(17)-en-19-oate
Alternate Name(s) Methyl (1S,4aR,5S)-5-(3-hydroxy-3-methyl-4-oxopentyl)-1,4a-dimethyl-6-methylenedecahydro-1-naphthalenecarboxylate
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Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-14-8-9-17-19(3,11-7-12-20(17,4)18(23)25-6)16(14)10-13-21(5,24)15(2)22/h16-17,24H,1,7-13H2,2-6H3/t16-,17?,19+,20-,21?/m0/s1
InChIKey AWHUAASAHJWMRQ-HJUTVMMFSA-N
Molecular Weight 350.499 g/mol
SMILES OC(CC[C@@]1([C@@]2(C([C@](C(=O)OC)(C)CCC2)CCC1=C)C)[H])(C(=O)C)C
SPLASH splash10-00du-6930000000-55f00ba0613cf46433b6
Source of Spectrum AC-1993-707-27
Wiley ID 811619