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Ent-kaur-16-en-19-oic acid
SpectraBase Compound ID C1fFprgAiNF
InChI InChI=1S/C20H30O2/c1-13-11-20-10-7-15-18(2,16(20)6-5-14(13)12-20)8-4-9-19(15,3)17(21)22/h14-16H,1,4-12H2,2-3H3,(H,21,22)/t14-,15-,16-,18+,19+,20+/m0/s1
InChIKey NIKHGUQULKYIGE-SHAPNJEPSA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YdQrvKatxq
Name Ent-kaur-16-en-19-oic acid
Alternate Name(s) (4R,4aS,6aS,9S,11aR,11bS)-4,11b-dimethyl-8-methylenetetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-13-11-20-10-7-15-18(2,16(20)6-5-14(13)12-20)8-4-9-19(15,3)17(21)22/h14-16H,1,4-12H2,2-3H3,(H,21,22)/t14-,15-,16-,18+,19+,20+/m0/s1
InChIKey NIKHGUQULKYIGE-SHAPNJEPSA-N
Literature Reference DOI 10.1002/jccs.200400131
Molecular Weight 302.458 g/mol
SMILES OC([C@]1([C@@]2([C@](CCC1)(C)[C@]1([C@@]3(CC2)C[C@@](CC1)([H])C(=C)C3)[H])[H])C)=O
SPLASH splash10-0zmi-2927000000-82d88494f486fe9efbe5
Source of Spectrum QA-51-873-6
Wiley ID 1795974