| SpectraBase Spectrum ID |
5tHT5v35IRb |
| Name |
Heptanoic acid, 3-(1,1-dimethylethyl)-6,6-dimethyl-2,5-dioxo-, methyl ester |
| CAS Registry Number |
65077-04-5 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H24O4 |
| InChI |
InChI=1S/C14H24O4/c1-13(2,3)9(11(16)12(17)18-7)8-10(15)14(4,5)6/h9H,8H2,1-7H3 |
| InChIKey |
VDJRYHPAEDLFDP-UHFFFAOYSA-N |
| Molecular Weight |
256.342 g/mol |
| SMILES |
C(C(CC(C(C)(C)C)=O)C(C)(C)C)(C(=O)OC)=O |
| SPLASH |
splash10-0002-0920000000-41944d6f0905691a4ff9 |
| Source of Spectrum |
SB-31-558-0 |
| Synonyms |
Methyl 3-tert-butyl-6,6-dimethyl-2,5-dioxoheptanoate
Methyl-6,6-dimethyl-3-t-butyl-2,5-dioxoheptanoate |
| Wiley ID |
1259709 |
