| SpectraBase Spectrum ID |
BUMjUJhJ3Ob |
| Name |
5-Acetyl-2-methylcyclohex-2-en-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H12O2 |
| InChI |
InChI=1S/C9H12O2/c1-6-3-4-8(7(2)10)5-9(6)11/h3,8H,4-5H2,1-2H3/t8-/m1/s1 |
| InChIKey |
HIFCQOWCDQXRJE-MRVPVSSYSA-N |
| Instrument Name |
ThermoFinnigan MAT 95XP |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jccs.202200035 |
| Molecular Weight |
152.193 g/mol |
| Optical Rotation |
[a]D23 = -10 (c = 0.04, CH2Cl2) |
| SMILES |
C1C(C(=CC[C@]1(C(C)=O)[H])C)=O |
| SPLASH |
splash10-0a4i-7900000000-4e9feaa365bafde3cb8c |
| Source of Spectrum |
QA-69-748-5 |
| Thin-Layer Chromatography |
Rf = 0.62 (PE-methyl-t-butyl ether, 2:1) |
| Wiley ID |
1873517 |
