| SpectraBase Spectrum ID |
Aj0yUqta9Fx |
| Name |
rac-(3R,3aR,4R,5R,6S,7S,7aS)-3-acetoxy-5,6-epoxyhexahydro-4,7-methanoisobenzofuran-1(3H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H12O5 |
| InChI |
InChI=1S/C11H12O5/c1-3(12)14-11-7-5-2-4(8-9(5)15-8)6(7)10(13)16-11/h4-9,11H,2H2,1H3/t4-,5+,6-,7+,8-,9+,11+/m0/s1 |
| InChIKey |
HWVUBOVTZMHDDE-PWFCOHEESA-N |
| Instrument Name |
Shimadzu GC-17A-QP5050A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/cbdv.201800557 |
| Molecular Weight |
224.212 g/mol |
| SMILES |
[C@]12([C@]3([C@@]([C@]([C@@]4([C@]2(O4)[H])[H])(C1)[H])([C@@](OC3=O)(OC(=O)C)[H])[H])[H])[H] |
| SPLASH |
splash10-0006-9100000000-6ca932b6d26547a75a11 |
| Source of Spectrum |
CBD-16-SM6-12 |
| Thin-Layer Chromatography |
Rf = 0.34 (hexane/EtOAc, 2:1) |
| Wiley ID |
1835399 |
