![Ethyl cis-6-Hydroxy-7-oxobicyclo[4.3.0]nonanecarboxylate](/api/spectrum/4DgontCjcJF/structure.png?h=300&w=458 "Ethyl cis-6-Hydroxy-7-oxobicyclo[4.3.0]nonanecarboxylate")
| SpectraBase Compound ID | DzY9P8mqPau |
|---|---|
| InChI | InChI=1S/C12H18O4/c1-2-16-10(14)11-6-3-4-7-12(11,15)9(13)5-8-11/h15H,2-8H2,1H3/t11-,12-/m0/s1 |
| InChIKey | ANFDSLYHZQRRPW-RYUDHWBXSA-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 | 4DgontCjcJF |
|---|---|
| Name | Ethyl cis-6-Hydroxy-7-oxobicyclo[4.3.0]nonanecarboxylate |
| Alternate Name(s) | ethyl (3aS,7aS)-7a-hydroxy-1-oxooctahydro-3aH-indene-3a-carboxylate (3aR,7aR)-7a-hydroxy-1-oxo-2,3,4,5,6,7-hexahydroindene-3a-carboxylic acid ethyl ester ethyl (3aR,7aR)-7a-hydroxy-1-oxo-2,3,4,5,6,7-hexahydroindene-3a-carboxylate ethyl (3aR,7aR)-7a-oxidanyl-1-oxidanylidene-2,3,4,5,6,7-hexahydroindene-3a-carboxylate |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H18O4 |
| InChI | InChI=1S/C12H18O4/c1-2-16-10(14)11-6-3-4-7-12(11,15)9(13)5-8-11/h15H,2-8H2,1H3/t11-,12-/m0/s1 |
| InChIKey | ANFDSLYHZQRRPW-RYUDHWBXSA-N |
| Molecular Weight | 226.272 g/mol |
| SMILES | O[C@@]12[C@](C(=O)OCC)(CCC2=O)CCCC1 |
| SPLASH | splash10-00di-0900000000-c233e998a875a375df21 |
| Source of Spectrum | J-63-9034-2 |
| Wiley ID | 1227375 |