| SpectraBase Spectrum ID |
9GMn3THrORh |
| Name |
Methyl 5,5-dimethyl-3-(2'-methylpropyl)-4-oxohexanoate |
| Alternate Name(s) |
methyl 3-isobutyl-5,5-dimethyl-4-oxohexanoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H24O3 |
| InChI |
InChI=1S/C13H24O3/c1-9(2)7-10(8-11(14)16-6)12(15)13(3,4)5/h9-10H,7-8H2,1-6H3 |
| InChIKey |
GEXCNXUMPUBHKI-UHFFFAOYSA-N |
| Molecular Weight |
228.332 g/mol |
| SMILES |
C(C(C(C)(C)C)=O)(CC(=O)OC)CC(C)C |
| SPLASH |
splash10-03di-0900000000-0be10c0a256ac4baa7ed |
| Source of Spectrum |
H-80-513-4 |
| Wiley ID |
1229795 |
