| SpectraBase Spectrum ID |
FOBaO7vCJF7 |
| Name |
2,4-Pentanedione, 3,3-dimethyl- |
| Alternate Name(s) |
3,3-Dimethyl-2,4-pentane dione
3,3-Dimethylacetylacetone
3,3-Dimethylpentane-2,4-dione
Dimethylacetylacetone
EINECS 221-551-5 |
| CAS Registry Number |
3142-58-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H12O2 |
| InChI |
InChI=1S/C7H12O2/c1-5(8)7(3,4)6(2)9/h1-4H3 |
| InChIKey |
SWGDHTSWHSSMLE-UHFFFAOYSA-N |
| Molecular Weight |
128.171 g/mol |
| SMILES |
C(C(=O)C)(C(=O)C)(C)C |
| SPLASH |
splash10-00di-9000000000-bed9124e9f9397bde485 |
| Source of Spectrum |
SO-0-689-5 |
| Wiley ID |
1540993 |
