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16beta-Hydro-ent-kauran-17-oic acid
SpectraBase Compound ID BM2JIDSNhne
InChI InChI=1S/C20H32O2/c1-18(2)8-4-9-19(3)15(18)7-10-20-11-13(5-6-16(19)20)14(12-20)17(21)22/h13-16H,4-12H2,1-3H3,(H,21,22)/t13-,14+,15+,16-,19+,20-/m0/s1
InChIKey KNCGYSOHQZGPKT-HKVXWICKSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1neCwCYUreX
Name 16beta-Hydro-ent-kauran-17-oic acid
Alternate Name(s) (4aR,6aS,8R,9S,11aR,11bR)-4,4,11b-trimethyltetradecahydro-6a,9-methanocyclohepta[a]naphthalene-8-carboxylic acid
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Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-18(2)8-4-9-19(3)15(18)7-10-20-11-13(5-6-16(19)20)14(12-20)17(21)22/h13-16H,4-12H2,1-3H3,(H,21,22)/t13-,14+,15+,16-,19+,20-/m0/s1
InChIKey KNCGYSOHQZGPKT-HKVXWICKSA-N
Literature Reference DOI 10.1002/jccs.200400131
Molecular Weight 304.474 g/mol
SMILES OC([C@]1([C@]2(CC[C@]3([C@@]4(CCCC([C@@]4([H])CC[C@]3(C2)C1)(C)C)C)[H])[H])[H])=O
SPLASH splash10-05g3-2931000000-a22b3db1849ea98b4b55
Source of Spectrum QA-51-872-2
Wiley ID 1795972