| SpectraBase Compound ID | 8qAGGyxPZhB |
|---|---|
| InChI | InChI=1S/C13H16O4/c1-16-12(14)8-6-5-7-3-2-4-9-10(7)11(8)13(15)17-9/h5,8-11H,2-4,6H2,1H3 |
| InChIKey | MWJQSNOCDXNXEL-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C13H16O4 |
| Exact Mass | 236.104859 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3ekkdKrxxLb |
|---|---|
| Name | (2aRS,3RS,8aSR,8bRS)-Methyl 2a,3,4,6,7,8,8a,8b-octahydro-2-oxo-1-oxa-acenaphthene-3-carboxylate |
| Alternate Name(s) | (2aRS,3SR,8aSR,8bRS)-Methyl 2s,3,4,6,7,8,8a,8b-octahydro-2-oxo-1-oxa-acenaphthene-3-carboxylate (2aRS,3SR,8aSR,8bRS)-methyl 2s,3,4,6,7,8,8a,8b-octahydro-2-oxo-1-oxa-acenaphthiene-3-carboxylate Methyl 2-oxo-2a,3,4,6,7,8,8a,8b-octahydro-2H-naphtho[1,8-bc]furan-3-carboxylate |
| CAS Registry Number | 122518-96-1 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16O4 |
| InChI | InChI=1S/C13H16O4/c1-16-12(14)8-6-5-7-3-2-4-9-10(7)11(8)13(15)17-9/h5,8-11H,2-4,6H2,1H3 |
| InChIKey | MWJQSNOCDXNXEL-UHFFFAOYSA-N |
| Molecular Weight | 236.267 g/mol |
| SMILES | C1(C2C3C(CCCC3O1)=CCC2C(=O)OC)=O |
| SPLASH | splash10-0006-9110000000-a39a792dd092e5741105 |
| Source of Spectrum | KC-1989-993-57 |
| Wiley ID | 1238090 |