| SpectraBase Spectrum ID |
9SZOkdkrwKJ |
| Name |
dimethyl(R)-(-)-2-(4-benzyloxy-3-methoxyphenyl)-4-oxo-1,1-hexanedicarboxylate |
| Alternate Name(s) |
dimethyl 2-{(1R)-1-[4-(benzyloxy)-3-methoxyphenyl]-3-oxopentyl}malonate |
| CAS Registry Number |
109012-84-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H28O7 |
| InChI |
InChI=1S/C24H28O7/c1-5-18(25)14-19(22(23(26)29-3)24(27)30-4)17-11-12-20(21(13-17)28-2)31-15-16-9-7-6-8-10-16/h6-13,19,22H,5,14-15H2,1-4H3/t19-/m0/s1 |
| InChIKey |
COLMBJSQQYQGGX-IBGZPJMESA-N |
| Molecular Weight |
428.481 g/mol |
| SMILES |
C([C@](c1cc(OC)c(cc1)OCc1ccccc1)(CC(=O)CC)[H])(C(=O)OC)C(=O)OC |
| SPLASH |
splash10-0006-9000200000-44bcaad6337b04407126 |
| Source of Spectrum |
K-120-1734-0 |
| Wiley ID |
1380729 |
