| SpectraBase Spectrum ID |
AztidKpksk4 |
| Name |
2-Pentanone, 4,4-dimethyl- |
| Alternate Name(s) |
4,4-Dimethyl-2-pentanone
4,4-Dimethylpentan-2-one
Methyl neoamyl ketone
Methyl neopentyl ketone
neo-C5H11COCH3
Neopentyl methyl ketone
EINECS 209-685-2 |
| CAS Registry Number |
590-50-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H14O |
| InChI |
InChI=1S/C7H14O/c1-6(8)5-7(2,3)4/h5H2,1-4H3 |
| InChIKey |
AZASWMGVGQEVCS-UHFFFAOYSA-N |
| Molecular Weight |
114.188 g/mol |
| SMILES |
CC(CC(C)=O)(C)C |
| SPLASH |
splash10-052f-9000000000-79da11d745dfe6bbc7b7 |
| Source of Spectrum |
NP-16-6442-0 |
| Wiley ID |
1095575 |
