![1H-Cyclohepta[a]naphthalene-4-carboxylic acid, tetradecahydro-4,8,9,11b-tetramethyl-, methyl ester](/api/spectrum/GSlnzT1CqrA/structure.png?h=300&w=458 "1H-Cyclohepta[a]naphthalene-4-carboxylic acid, tetradecahydro-4,8,9,11b-tetramethyl-, methyl ester")
| SpectraBase Compound ID | 6slbQTZLEmq |
|---|---|
| InChI | InChI=1S/C21H36O2/c1-14-7-9-17-16(13-15(14)2)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h14-18H,6-13H2,1-5H3 |
| InChIKey | LZECAFJNDATSJN-UHFFFAOYSA-N |
| Mol Weight | 320.5 g/mol |
| Molecular Formula | C21H36O2 |
| Exact Mass | 320.27153 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GSlnzT1CqrA |
|---|---|
| Name | 1H-Cyclohepta[a]naphthalene-4-carboxylic acid, tetradecahydro-4,8,9,11b-tetramethyl-, methyl ester |
| CAS Registry Number | 33536-88-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H36O2 |
| InChI | InChI=1S/C21H36O2/c1-14-7-9-17-16(13-15(14)2)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h14-18H,6-13H2,1-5H3 |
| InChIKey | LZECAFJNDATSJN-UHFFFAOYSA-N |
| Molecular Weight | 320.517 g/mol |
| SMILES | C12CC(C(CCC2C2(CCCC(C2CC1)(C)C(OC)=O)C)C)C |
| SPLASH | splash10-03e9-4900000000-cf16ef7b36b2688cf24a |
| Source of Spectrum | Va-0-0-0 |
| Synonyms | Methyl 4,8,9,11b-tetramethyltetradecahydro-1H-cyclohepta[a]naphthalene-4-carboxylate 1H-Cyclohepta[a]naphthalene-4-carboxylic acid, tetradecahydro-4,8,9,11b-tetramethyl-, methyl ester, (4R,4aR,6aS,11aS,11bR)-(+)- 4,8,9,11b-tetramethyl-2,3,4a,5,6,6a,7,8,9,10,11,11a-dodecahydro-1H-cyclohepta[a]naphthalene-4-carboxylic acid methyl ester Methyl 4,8,9,11b-tetramethyl-2,3,4a,5,6,6a,7,8,9,10,11,11a-dodecahydro-1H-cyclohepta[a]naphthalene-4-carboxylate |
| Wiley ID | 743911 |