| SpectraBase Spectrum ID |
3bAtbe8hp0i |
| Name |
Cyclopenta-1,3-dioxin-4a(4H)-acetic acid, 2-(1,1-dimethylethyl)tetrahydro-4-oxo-, methyl ester, [2S-(2.alpha.,4a.beta.,7a.beta.)]- |
| CAS Registry Number |
124898-95-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H22O5 |
| InChI |
InChI=1S/C14H22O5/c1-13(2,3)12-18-9-6-5-7-14(9,11(16)19-12)8-10(15)17-4/h9,12H,5-8H2,1-4H3/t9-,12-,14?/m0/s1 |
| InChIKey |
MBJLIMWXCNRESG-LLBSRUCJSA-N |
| Molecular Weight |
270.325 g/mol |
| SMILES |
C12(C(O[C@](O[C@]2(CCC1)[H])(C(C)(C)C)[H])=O)CC(=O)OC |
| SPLASH |
splash10-052f-4920000000-0b18efbc0be26c4486c5 |
| Source of Spectrum |
H-72-703-5 |
| Synonyms |
Methyl ((2S,7aS)-2-tert-butyl-4-oxotetrahydrocyclopenta[d][1,3]dioxin-4a(4H)-yl)acetate
Methyl (2S,4aR,7aS)-2-(t-butyl)-4,4a,5,6,7,7a-hexahydro-4-oxocyclopenta[d]dioxine-4-acetate |
| Wiley ID |
1274026 |
![Cyclopenta-1,3-dioxin-4a(4H)-acetic acid, 2-(1,1-dimethylethyl)tetrahydro-4-oxo-, methyl ester, [2S-(2.alpha.,4a.beta.,7a.beta.)]-](/api/spectrum/3bAtbe8hp0i/structure.png?h=300&w=458 "Cyclopenta-1,3-dioxin-4a(4H)-acetic acid, 2-(1,1-dimethylethyl)tetrahydro-4-oxo-, methyl ester, [2S-(2.alpha.,4a.beta.,7a.beta.)]-")
