![3-[(3'aS,4'S,7'aS)-1'-keto-7'a-methyl-spiro[1,3-dioxolane-2,5'-2,3,3a,4,6,7-hexahydroindene]-4'-yl]propionic acid methyl ester](/api/spectrum/3YVRyWUAl87/structure.png?h=300&w=458 "3-[(3'aS,4'S,7'aS)-1'-keto-7'a-methyl-spiro[1,3-dioxolane-2,5'-2,3,3a,4,6,7-hexahydroindene]-4'-yl]propionic acid methyl ester")
| SpectraBase Compound ID | LTfXfnDic3S |
|---|---|
| InChI | InChI=1S/C16H24O5/c1-15-7-8-16(20-9-10-21-16)12(4-6-14(18)19-2)11(15)3-5-13(15)17/h11-12H,3-10H2,1-2H3/t11-,12-,15-/m0/s1 |
| InChIKey | MAIYIJZESLAJNR-HUBLWGQQSA-N |
| Mol Weight | 296.36 g/mol |
| Molecular Formula | C16H24O5 |
| Exact Mass | 296.162374 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3YVRyWUAl87 |
|---|---|
| Name | 3-[(3'aS,4'S,7'aS)-1'-keto-7'a-methyl-spiro[1,3-dioxolane-2,5'-2,3,3a,4,6,7-hexahydroindene]-4'-yl]propionic acid methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H24O5 |
| InChI | InChI=1S/C16H24O5/c1-15-7-8-16(20-9-10-21-16)12(4-6-14(18)19-2)11(15)3-5-13(15)17/h11-12H,3-10H2,1-2H3/t11-,12-,15-/m0/s1 |
| InChIKey | MAIYIJZESLAJNR-HUBLWGQQSA-N |
| Molecular Weight | 296.363 g/mol |
| SMILES | [C@@]12([C@]([C@](CCC(=O)OC)(C3(CC2)OCCO3)[H])(CCC1=O)[H])C |
| SPLASH | splash10-000j-9320000000-72055ead5bd6bcbc47e2 |
| Source of Spectrum | E1-40-1122-19 |
| Synonyms | 3-[(3'aS,4'S,7'aS)-7'a-methyl-1'-oxo-4'-spiro[1,3-dioxolane-2,5'-2,3,3a,4,6,7-hexahydroindene]yl]propanoic acid methyl ester Methyl 3-[(3'aS,4'S,7'aS)-7'a-methyl-1'-oxidanylidene-spiro[1,3-dioxolane-2,5'-2,3,3a,4,6,7-hexahydroindene]-4'-yl]propanoate Methyl 3-[(3'aS,4'S,7'aS)-7'a-methyl-1'-oxo-spiro[1,3-dioxolane-2,5'-2,3,3a,4,6,7-hexahydroindene]-4'-yl]propanoate |
| Wiley ID | 1599176 |