| SpectraBase Spectrum ID |
5JKPxwfBaGg |
| Name |
(3,5,5-(2)H3)-4-Isopropyl-3-cyclohexen-1-one |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H11D3O |
| InChI |
InChI=1S/C9H14O/c1-7(2)8-3-5-9(10)6-4-8/h3,7H,4-6H2,1-2H3/i3D,4D2 |
| InChIKey |
MDXYRLOGARYUFV-MPRALRHZSA-N |
| Instrument Name |
Shimadzu GC-MS-QP2020 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.202000684 |
| Molecular Weight |
141.228 g/mol |
| Reported Formula |
C9H11(2)H3O |
| SMILES |
C1C([D])=C(C(C)C)C([D])([D])CC1=O |
| SPLASH |
splash10-001i-9100000000-62906e839c7cf9b1b9ef |
| Source of Spectrum |
U1-2020-4898-18d |
| Thin-Layer Chromatography |
Rf = 0.39 (SiO2, n-pentane/Et2O, 2:1) |
| Wiley ID |
1860851 |
