| SpectraBase Spectrum ID |
K2H3Gcq9AF1 |
| Name |
Butanedioic acid, 2-phenyl-2-(phenylthio)-, 1-methyl ester |
| Alternate Name(s) |
1-Methyl hydrogen 2-phenyl-2-phenylthiosuccinate
4-Methoxy-4-oxo-3-phenyl-3-(phenylsulfanyl)butanoic acid |
| CAS Registry Number |
108378-55-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H16O4S |
| InChI |
InChI=1S/C17H16O4S/c1-21-16(20)17(12-15(18)19,13-8-4-2-5-9-13)22-14-10-6-3-7-11-14/h2-11H,12H2,1H3,(H,18,19) |
| InChIKey |
JUJOXLCRFQTWCX-UHFFFAOYSA-N |
| Molecular Weight |
316.371 g/mol |
| SMILES |
OC(CC(C(=O)OC)(Sc1ccccc1)c1ccccc1)=O |
| SPLASH |
splash10-0r0r-0911000000-7386115559362ec3b13f |
| Source of Spectrum |
KC-1986-1704-0 |
| Wiley ID |
1316645 |
