| SpectraBase Spectrum ID |
Hun5GWoP3hL |
| Name |
Propanoic acid, 3-[[3-(4-chlorophenyl)-3-hydroxy-1-thioxo-2-propenyl]thio]-, methyl ester |
| CAS Registry Number |
72347-57-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H13ClO3S2 |
| InChI |
InChI=1S/C13H13ClO3S2/c1-17-12(16)6-7-19-13(18)8-11(15)9-2-4-10(14)5-3-9/h2-5,8,18H,6-7H2,1H3/b13-8+ |
| InChIKey |
HBTZKZFZQPESSA-MDWZMJQESA-N |
| Molecular Weight |
316.817 g/mol |
| SMILES |
S\C(SCCC(OC)=O)=C/C(=O)c1ccc(Cl)cc1 |
| SPLASH |
splash10-000i-3920000000-25f02b183b5406f7fc5a |
| Source of Spectrum |
F-28-5350-8 |
| Synonyms |
Methyl 3-([(2Z)-3-(4-chlorophenyl)-3-hydroxy-2-propenethioyl]sulfanyl)propanoate
3-[[(E)-3-(4-chlorophenyl)-1-mercapto-3-oxoprop-1-enyl]thio]propanoic acid methyl ester
3-[[(E)-3-(4-chlorophenyl)-3-keto-1-mercapto-prop-1-enyl]thio]propionic acid methyl ester
Methyl 3-[(E)-3-(4-chlorophenyl)-3-oxidanylidene-1-sulfanyl-prop-1-enyl]sulfanylpropanoate
Methyl 3-[(E)-3-(4-chlorophenyl)-3-oxo-1-sulfanyl-prop-1-enyl]sulfanylpropanoate |
| Wiley ID |
1316366 |
![Propanoic acid, 3-[[3-(4-chlorophenyl)-3-hydroxy-1-thioxo-2-propenyl]thio]-, methyl ester](/api/spectrum/Hun5GWoP3hL/structure.png?h=300&w=458 "Propanoic acid, 3-[[3-(4-chlorophenyl)-3-hydroxy-1-thioxo-2-propenyl]thio]-, methyl ester")
