| SpectraBase Spectrum ID |
4T6v7Abb12D |
| Name |
4-Benzoyl-5-hydroxy-6-propionyl-isophthalic acid diethyl ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H22O7 |
| InChI |
InChI=1S/C22H22O7/c1-4-16(23)17-14(21(26)28-5-2)12-15(22(27)29-6-3)18(20(17)25)19(24)13-10-8-7-9-11-13/h7-12,25H,4-6H2,1-3H3 |
| InChIKey |
MCIGDQYSXALYSN-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol0625536 |
| Molecular Weight |
398.411 g/mol |
| SMILES |
Oc1c(c(C(=O)OCC)cc(c1C(c1ccccc1)=O)C(OCC)=O)C(=O)CC |
| SPLASH |
splash10-0002-0096000000-b02b35f880a7618d50c4 |
| Source of Spectrum |
A1-8-5673/SM18-10b |
| Synonyms |
Diethyl 4-benzoyl-5-hydroxy-6-propionylisophthalate |
| Wiley ID |
1760961 |
