| SpectraBase Compound ID | 7JOTzVeQee |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-4-7(9)5(2)6(3)8/h5H,4H2,1-3H3 |
| InChIKey | CAVUEALRYKNYRW-UHFFFAOYSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 2odTZ2WEio9 |
|---|---|
| Name | 2,4-Hexanedione, 3-methyl- |
| CAS Registry Number | 4220-52-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-4-7(9)5(2)6(3)8/h5H,4H2,1-3H3 |
| InChIKey | CAVUEALRYKNYRW-UHFFFAOYSA-N |
| Molecular Weight | 128.171 g/mol |
| SMILES | CC(C(C(CC)=O)C)=O |
| SPLASH | splash10-0a4l-9000000000-c02a95bef5bf62569fb9 |
| Source of Spectrum | OV-6-631-1 |
| Synonyms | 3-Methylhexane-2,4-dione 3-Methyl-2,4-hexanedione |
| Wiley ID | 1547622 |