| SpectraBase Spectrum ID |
LrCKdCYtPjy |
| Name |
Etacrynic acid ME |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
316.026914327 u |
| Formula |
C14H14Cl2O4 |
| InChI |
InChI=1S/C14H14Cl2O4/c1-4-8(2)14(18)9-5-6-10(13(16)12(9)15)20-7-11(17)19-3/h5-6H,2,4,7H2,1,3H3 |
| InChIKey |
XFNMYPXAINMYAC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
317.168 g/mol |
| Nominal Mass |
316 u |
| Quality |
759 |
| Retention Index |
2190 |
| SMILES |
C1(=C(C(=C(C=C1)OCC(OC)=O)Cl)Cl)C(C(CC)=C)=O |
| SPLASH |
splash10-03dm-7290000000-fc39d2bf5e34e5f76180 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2R,3S)-1,3,4-tris(acetyloxy)butan-2-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001332 |
![Acetic acid, [2,3-dichloro-4-(2-methylene-1-oxobutyl)phenoxy]-, methyl ester](/api/spectrum/LrCKdCYtPjy/structure.png?h=300&w=458 "Acetic acid, [2,3-dichloro-4-(2-methylene-1-oxobutyl)phenoxy]-, methyl ester")
