![(3aR,6aS)-3-oxo-1,1-dimethyl-tetrahydrocyclopenta[c]furan-3a-carboxylic acid ethyl ester](/api/spectrum/H1iOPdWUevz/structure.png?h=300&w=458 "(3aR,6aS)-3-oxo-1,1-dimethyl-tetrahydrocyclopenta[c]furan-3a-carboxylic acid ethyl ester")
| SpectraBase Compound ID | KIDbO9rlTEK |
|---|---|
| InChI | InChI=1S/C12H18O4/c1-4-15-9(13)12-7-5-6-8(12)11(2,3)16-10(12)14/h8H,4-7H2,1-3H3/t8-,12-/m1/s1 |
| InChIKey | FXWXLTHELRYNAA-PRHODGIISA-N |
| Mol Weight | 226.27 g/mol |
| Molecular Formula | C12H18O4 |
| Exact Mass | 226.120509 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | H1iOPdWUevz |
|---|---|
| Name | (3aR,6aS)-3-oxo-1,1-dimethyl-tetrahydrocyclopenta[c]furan-3a-carboxylic acid ethyl ester |
| Alternate Name(s) | Ethyl (3aR,6aS)-1,1-dimethyl-3-oxotetrahydro-1H-cyclopenta[c]furan-3a(3H)-carboxylate Ethyl 3-oxo-1,1-dimethyl-tetrahydrocyclopenta[c]furan-3a-carboxylate (3aS,6aR)-3,3-dimethyl-1-oxo-3a,4,5,6-tetrahydrocyclopenta[c]furan-6a-carboxylic acid ethyl ester Ethyl (3aS,6aR)-3,3-dimethyl-1-oxo-3a,4,5,6-tetrahydrocyclopenta[c]furan-6a-carboxylate Ethyl (3aS,6aR)-3,3-dimethyl-1-oxidanylidene-3a,4,5,6-tetrahydrocyclopenta[c]furan-6a-carboxylate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18O4 |
| InChI | InChI=1S/C12H18O4/c1-4-15-9(13)12-7-5-6-8(12)11(2,3)16-10(12)14/h8H,4-7H2,1-3H3/t8-,12-/m1/s1 |
| InChIKey | FXWXLTHELRYNAA-PRHODGIISA-N |
| Molecular Weight | 226.272 g/mol |
| SMILES | [C@]12(C(OC([C@]2(CCC1)[H])(C)C)=O)C(=O)OCC |
| SPLASH | splash10-0apr-2910000000-777a2b9b94a0b20a5094 |
| Source of Spectrum | K1-2001-3347-14 |
| Wiley ID | 814438 |