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Methyl 17-hydroxylabda-13(16),14-dien-19-oate
SpectraBase Compound ID GFNsuOj19bs
InChI InChI=1S/C21H34O3/c1-6-15(2)8-10-17-16(3)9-11-18-20(4,19(23)24-5)12-7-13-21(17,18)14-22/h6,16-18,22H,1-2,7-14H2,3-5H3/t16-,17-,18-,20?,21-/m0/s1
InChIKey XJXIZNRDHLAVPA-KTVVOVABSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fIYc2MZCaf
Name Methyl 17-hydroxylabda-13(16),14-dien-19-oate
Alternate Name(s) Methyl (4aS,5S,6S,8aR)-4a-(hydroxymethyl)-1,6-dimethyl-5-(3-methylene-4-pentenyl)decahydro-1-naphthalenecarboxylate
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Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-6-15(2)8-10-17-16(3)9-11-18-20(4,19(23)24-5)12-7-13-21(17,18)14-22/h6,16-18,22H,1-2,7-14H2,3-5H3/t16-,17-,18-,20?,21-/m0/s1
InChIKey XJXIZNRDHLAVPA-KTVVOVABSA-N
Molecular Weight 334.500 g/mol
SMILES OC[C@]12[C@](C(C(=O)OC)(C)CCC2)(CC[C@@]([C@@]1(CCC(C=C)=C)[H])(C)[H])[H]
SPLASH splash10-0596-9410000000-bbf6367e88ccddf9f025
Source of Spectrum Y4-89-721-22
Wiley ID 1550363