| SpectraBase Spectrum ID |
7FfDG8qkB1h |
| Name |
2,2,4-Trimethyl-3-pentanone |
| Alternate Name(s) |
3-Pentanone, 2,2,4-trimethyl-
Isopropyl tert-butyl ketone
Pentamethylacetone
tert-Butyl isopropyl ketone
tert-C4H9CO(iso-C3H7) |
| CAS Registry Number |
5857-36-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C8H16O |
| InChI |
InChI=1S/C8H16O/c1-6(2)7(9)8(3,4)5/h6H,1-5H3 |
| InChIKey |
OVCHQRXVZXVQNQ-UHFFFAOYSA-N |
| Molecular Weight |
128.215 g/mol |
| SMILES |
CC(C)(C(=O)C(C)C)C |
| SPLASH |
splash10-0a4l-9000000000-35a46406dc5de1f1304a |
| Source of Spectrum |
NP-0-7183-0 |
| Wiley ID |
1096728 |
