| SpectraBase Spectrum ID |
5vCLtVhcdVO |
| Name |
Benzenepentanoic acid, .gamma.-acetyl-.beta.-oxo-, methyl ester |
| Alternate Name(s) |
Methyl 2-benzyl-3,5-dioxohexanoate
Methyl 4-benzyl-3,5-dioxohexanoate |
| CAS Registry Number |
129006-51-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H16O4 |
| InChI |
InChI=1S/C14H16O4/c1-10(15)12(13(16)9-14(17)18-2)8-11-6-4-3-5-7-11/h3-7,12H,8-9H2,1-2H3 |
| InChIKey |
ZLDGJIYKKXMUQK-UHFFFAOYSA-N |
| Molecular Weight |
248.278 g/mol |
| SMILES |
C(C(C(=O)C)Cc1ccccc1)(CC(=O)OC)=O |
| SPLASH |
splash10-0f76-9800000000-cf47adebf5061c34991c |
| Source of Spectrum |
F-46-2042-6 |
| Wiley ID |
1251062 |
