| SpectraBase Spectrum ID |
Hu3sLQcjqiF |
| Name |
(3S,5R,8S)-3,8-Dimethyl-5-[(2R)-2-methyloxiran-2-yl]-3,4,5,6,7,8-hexahydroazulen-1(2H)-one |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H22O2 |
| InChI |
InChI=1S/C15H22O2/c1-9-4-5-11(15(3)8-17-15)7-12-10(2)6-13(16)14(9)12/h9-11H,4-8H2,1-3H3/t9-,10-,11+,15-/m0/s1 |
| InChIKey |
NEABZHWVRAIURO-ZVXAKGHKSA-N |
| Instrument Name |
Agilent Technologies 6890-5973N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np500819f |
| Molecular Weight |
234.339 g/mol |
| Reported Formula |
C15H22O2 |
| SMILES |
C1(C[C@](C)(C2=C1[C@](CC[C@](C2)([C@]1(C)CO1)[H])(C)[H])[H])=O |
| SPLASH |
splash10-056s-2900000000-23f1ac698b86cf3717fd |
| Source of Spectrum |
G4-78-141-11a |
| Wiley ID |
1865811 |
![(3S,5R,8S)-3,8-Dimethyl-5-[(2R)-2-methyloxiran-2-yl]-3,4,5,6,7,8-hexahydroazulen-1(2H)-one](/api/spectrum/Hu3sLQcjqiF/structure.png?h=300&w=458 "(3S,5R,8S)-3,8-Dimethyl-5-[(2R)-2-methyloxiran-2-yl]-3,4,5,6,7,8-hexahydroazulen-1(2H)-one")
