| SpectraBase Spectrum ID |
LWTVc3TAEW0 |
| Name |
8-Acetoxy-1-methyl-4-(trimethylacetoxy)-1.beta.,3a.alpha.,4.beta.,5,8.beta.,8a.alpha.-hexahydroazulen-2(3H)-one |
| Alternate Name(s) |
(1R,3aR,4S,8R,8aR)-8-(acetyloxy)-1-methyl-2-oxo-1,2,3,3a,4,5,8,8a-octahydro-4-azulenyl pivalate |
| CAS Registry Number |
112021-68-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H26O5 |
| InChI |
InChI=1S/C18H26O5/c1-10-13(20)9-12-14(23-17(21)18(3,4)5)7-6-8-15(16(10)12)22-11(2)19/h6,8,10,12,14-16H,7,9H2,1-5H3/t10-,12-,14-,15+,16-/m0/s1 |
| InChIKey |
UPAKSZKAUYDHSF-QJXWRWMASA-N |
| Molecular Weight |
322.401 g/mol |
| SMILES |
[C@@]12([C@@]([C@](OC(=O)C)(C=CC[C@@]2(OC(C(C)(C)C)=O)[H])[H])([C@@](C)(C(C1)=O)[H])[H])[H] |
| SPLASH |
splash10-08fr-7930000000-c293b8649c6472ffc56a |
| Source of Spectrum |
J-53-442-3 |
| Wiley ID |
1321711 |
