| SpectraBase Spectrum ID |
6bdPccSAElb |
| Name |
5-[(E)-3-Hydroxypropenyl]-2,2-dimethylbenzo[1,3]dioxin-4-one |
| Alternate Name(s) |
(E)-5-(3-hydroxyprop-1-en-1-yl)-2,2-dimethyl-4H-benzo[d][1,3]dioxin-4-one
2,2-Dimethyl-5-[(E)-3-oxidanylprop-1-enyl]-1,3-benzodioxin-4-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O4 |
| InChI |
InChI=1S/C13H14O4/c1-13(2)16-10-7-3-5-9(6-4-8-14)11(10)12(15)17-13/h3-7,14H,8H2,1-2H3/b6-4+ |
| InChIKey |
BEBAKDZNJJTXJR-GQCTYLIASA-N |
| Literature Reference DOI |
10.1021/ol070240k |
| Molecular Weight |
234.251 g/mol |
| SMILES |
OC\C=C\c1cccc2c1C(OC(C)(C)O2)=O |
| SPLASH |
splash10-0092-1910000000-f667e974e361da8cd357 |
| Source of Spectrum |
A1-9-1453/SMS2-4 |
| Wiley ID |
1758053 |
![5-[(E)-3-Hydroxypropenyl]-2,2-dimethylbenzo[1,3]dioxin-4-one](/api/spectrum/6bdPccSAElb/structure.png?h=300&w=458 "5-[(E)-3-Hydroxypropenyl]-2,2-dimethylbenzo[1,3]dioxin-4-one")
