| SpectraBase Spectrum ID |
5yRiiT4oYPH |
| Name |
1-Methyl-4-(methylethyl)-bicyclo[2.2.2]oct -5- en-2-one |
| Classification |
Cyclohexenones |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
178.135765199 u |
| Formula |
C12H18O |
| InChI |
InChI=1S/C12H18O/c1-9(2)12-6-4-11(3,5-7-12)10(13)8-12/h4,6,9H,5,7-8H2,1-3H3/t11-,12-/m1/s1 |
| InChIKey |
DAJMATPOHFJMDC-VXGBXAGGSA-N |
| Molecular Weight |
178.275 g/mol |
| Number of Peaks |
6 |
| SMILES |
C1[C@]2(CC([C@@](C1)(C=C2)C)=O)C(C)C |
| SPLASH |
splash10-0079-2900000000-61b76525c0ae9bf6be2e |
| Source of Spectrum |
FF-8-299-9 (DOI: 10.1002/ffj.2730080603) |
| Synonyms |
(1R,4R)-4-isopropyl-1-methylbicyclo[2.2.2]oct-5-en-2-one |
| Wiley ID |
1801279 |
![1-Methyl-4-(methylethyl)-bicyclo[2.2.2]oct -5- en-2-one](/api/spectrum/5yRiiT4oYPH/structure.png?h=300&w=458 "1-Methyl-4-(methylethyl)-bicyclo[2.2.2]oct -5- en-2-one")
