| SpectraBase Spectrum ID |
IIG23hoX0TH |
| Name |
Propanoic acid, 2-methyl-, 2-[1-[(benzoyloxy)methyl]ethenyl]-4-hydroxy-5-methylphenyl ester |
| CAS Registry Number |
62458-41-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H22O5 |
| InChI |
InChI=1S/C21H22O5/c1-13(2)20(23)26-19-10-14(3)18(22)11-17(19)15(4)12-25-21(24)16-8-6-5-7-9-16/h5-11,13,22H,4,12H2,1-3H3 |
| InChIKey |
NPKDYJXYRHYGEQ-UHFFFAOYSA-N |
| Molecular Weight |
354.402 g/mol |
| SMILES |
Oc1c(cc(c(c1)C(COC(=O)c1ccccc1)=C)OC(=O)C(C)C)C |
| SPLASH |
splash10-03di-1920000000-746e6867660e2e4d9a04 |
| Source of Spectrum |
K-110-312-0 |
| Synonyms |
10-Benzoyloxy-6-hydroxy-8,9-dehydrothymol isobutyrate
2-[5-hydroxy-2-(isobutyryloxy)-4-methylphenyl]-2-propenyl benzoate |
| Wiley ID |
1344676 |
![Propanoic acid, 2-methyl-, 2-[1-[(benzoyloxy)methyl]ethenyl]-4-hydroxy-5-methylphenyl ester](/api/spectrum/IIG23hoX0TH/structure.png?h=300&w=458 "Propanoic acid, 2-methyl-, 2-[1-[(benzoyloxy)methyl]ethenyl]-4-hydroxy-5-methylphenyl ester")
