| SpectraBase Spectrum ID |
Ky3u155JpZa |
| Name |
Hexanoic acid, 2-methyl-3-oxo-, ethyl ester |
| Alternate Name(s) |
Ethyl 2,5-dimethyl-3-oxopentanoate
Ethyl 2-methyl-3-oxohexanoate
2-methyl-3-oxohexanoic acid ethyl ester
3-keto-2-methyl-hexanoic acid ethyl ester
ethyl 2-methyl-3-oxo-hexanoate
ethyl 2-methyl-3-oxidanylidene-hexanoate |
| CAS Registry Number |
29304-40-3 |
| Comments |
Removed - expert review: contamination (chloroform)) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H16O3 |
| InChI |
InChI=1S/C9H16O3/c1-4-6-8(10)7(3)9(11)12-5-2/h7H,4-6H2,1-3H3 |
| InChIKey |
ZHDUQUQKEAZVPG-UHFFFAOYSA-N |
| Molecular Weight |
172.224 g/mol |
| SMILES |
CC(C(OCC)=O)C(=O)CCC |
| SPLASH |
splash10-001r-9000000000-593b2a47e55449ad51e7 |
| Source of Spectrum |
W5-1989-6843-0 |
| Wiley ID |
1168674 |
