| SpectraBase Spectrum ID |
vcO6uupfra |
| Name |
rel-(1S,5S,8S)-1,1-dimethylethyl 5-(8-iodo-7-oxo-5,8-dimethyl-6-oxabicyclo[3.2.1]oct-2-en-1-yl)-2(E)-pentenoate |
| Alternate Name(s) |
tert-Butyl (2E)-5-[(1S,5S,8S)-8-iodo-5,8-dimethyl-7-oxo-6-oxabicyclo[3.2.1]oct-2-en-1-yl]-2-pentenoate |
| CAS Registry Number |
114837-93-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H25IO4 |
| InChI |
InChI=1S/C18H25IO4/c1-15(2,3)22-13(20)9-6-7-11-18-12-8-10-16(4,17(18,5)19)23-14(18)21/h6,8-9,12H,7,10-11H2,1-5H3/b9-6+/t16-,17+,18-/m0/s1 |
| InChIKey |
GJCKPHHASHQUNW-VMHNCFKSSA-N |
| Molecular Weight |
432.298 g/mol |
| SMILES |
[C@]12(C(O[C@@]([C@]2(I)C)(C)CC=C1)=O)CC\C=C\C(OC(C)(C)C)=O |
| SPLASH |
splash10-0aor-2920000000-03426cb38be5b1082140 |
| Source of Spectrum |
J-53-3216-34 |
| Wiley ID |
1382119 |
![rel-(1S,5S,8S)-1,1-dimethylethyl 5-(8-iodo-7-oxo-5,8-dimethyl-6-oxabicyclo[3.2.1]oct-2-en-1-yl)-2(E)-pentenoate](/api/spectrum/vcO6uupfra/structure.png?h=300&w=458 "rel-(1S,5S,8S)-1,1-dimethylethyl 5-(8-iodo-7-oxo-5,8-dimethyl-6-oxabicyclo[3.2.1]oct-2-en-1-yl)-2(E)-pentenoate")
