| SpectraBase Spectrum ID |
4Wj7XFfGVjD |
| Name |
2-Cyclohexen-1-one, 3-(3,3-dimethyl-1-butynyl)-5,5-dimethyl- |
| Alternate Name(s) |
3-(3,3-dimethyl-1-butynyl)-5,5-dimethyl-2-cyclohexen-1-one
3-[(t-butyl)ethynyl]-5,5-dimethyl-1-oxocyclohex-2-ene |
| CAS Registry Number |
130660-07-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20O |
| InChI |
InChI=1S/C14H20O/c1-13(2,3)7-6-11-8-12(15)10-14(4,5)9-11/h8H,9-10H2,1-5H3 |
| InChIKey |
ZBFAVCHBNZZOBE-UHFFFAOYSA-N |
| Molecular Weight |
204.313 g/mol |
| SMILES |
C(#CC(C)(C)C)C1=CC(=O)CC(C1)(C)C |
| SPLASH |
splash10-0pb9-0960000000-4a55e3aeb788fcd6172c |
| Source of Spectrum |
C-113-3908-3 |
| Wiley ID |
1202382 |
