| SpectraBase Spectrum ID |
6i0xjyV044B |
| Name |
2-Hydroxy-3,5,5-trimethylcyclohex-2-en-1,4-dione |
| 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 |
168.078644243 u |
| Formula |
C9H12O3 |
| InChI |
InChI=1S/C9H12O3/c1-5-7(11)6(10)4-9(2,3)8(5)12/h11H,4H2,1-3H3 |
| InChIKey |
BSRFZJMVFOPNKR-UHFFFAOYSA-N |
| Instrument Name |
HP 5890 Series II-5972 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jsfa.3679 |
| Molecular Weight |
168.192 g/mol |
| Number of Peaks |
4 |
| SMILES |
OC=1C(CC(C(C1C)=O)(C)C)=O |
| SPLASH |
splash10-0a59-9100000000-5c10febee1ff3d7c8b72 |
| Source of Spectrum |
SFA-89-1953-14 (DOI: 10.1002/jsfa.3679) |
| Wiley ID |
1840246 |
