![(1RS,2SR)-Methyl- 2,7,7-Trimethyl-3-oxobicyclo[3.3.0]oct-4-en-2-acetate](/api/spectrum/20XpdboXzsV/structure.png?h=300&w=458 "(1RS,2SR)-Methyl- 2,7,7-Trimethyl-3-oxobicyclo[3.3.0]oct-4-en-2-acetate")
| SpectraBase Compound ID | 9FFKwNmpfN0 |
|---|---|
| InChI | InChI=1S/C14H20O3/c1-13(2)6-9-5-11(15)14(3,10(9)7-13)8-12(16)17-4/h5,10H,6-8H2,1-4H3/t10-,14+/m1/s1 |
| InChIKey | FJEGGYQLFLWLMM-YGRLFVJLSA-N |
| Mol Weight | 236.31 g/mol |
| Molecular Formula | C14H20O3 |
| Exact Mass | 236.141245 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 20XpdboXzsV |
|---|---|
| Name | (1RS,2SR)-Methyl- 2,7,7-Trimethyl-3-oxobicyclo[3.3.0]oct-4-en-2-acetate |
| Alternate Name(s) | Methyl- 2,7,7-Trimethyl-3-oxobicyclo[3.3.0]oct-4-en-2-acetate isomer ((1S,6aR)-1,5,5-Trimethyl-2-oxo-1,2,4,5,6,6a-hexahydro-pentalen-1-yl)-acetic acid methyl ester Methyl (1,5,5-trimethyl-2-oxo-1,2,4,5,6,6a-hexahydro-1-pentalenyl)acetate 2-[(1S,6aR)-1,5,5-trimethyl-2-oxo-6,6a-dihydro-4H-pentalen-1-yl]acetic acid methyl ester Methyl 2-[(1S,6aR)-1,5,5-trimethyl-2-oxo-6,6a-dihydro-4H-pentalen-1-yl]acetate Methyl 2-[(1S,6aR)-1,5,5-trimethyl-2-oxidanylidene-6,6a-dihydro-4H-pentalen-1-yl]ethanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H20O3 |
| InChI | InChI=1S/C14H20O3/c1-13(2)6-9-5-11(15)14(3,10(9)7-13)8-12(16)17-4/h5,10H,6-8H2,1-4H3/t10-,14+/m1/s1 |
| InChIKey | FJEGGYQLFLWLMM-YGRLFVJLSA-N |
| Molecular Weight | 236.311 g/mol |
| SMILES | C1=2[C@]([C@@](CC(=O)OC)(C)C(C2)=O)(CC(C1)(C)C)[H] |
| SPLASH | splash10-056u-9810000000-317ccb4454ac075016c5 |
| Source of Spectrum | F-50-420-2 |
| Wiley ID | 1238468 |