| SpectraBase Spectrum ID |
35a4aeZVbzX |
| Name |
Benzenepropanoic acid, .alpha.-(1-methylethenyl)-.alpha.-(phenylthio)-, methyl ester |
| CAS Registry Number |
86895-79-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H20O2S |
| InChI |
InChI=1S/C19H20O2S/c1-15(2)19(18(20)21-3,14-16-10-6-4-7-11-16)22-17-12-8-5-9-13-17/h4-13H,1,14H2,2-3H3 |
| InChIKey |
DHLWOAZVQFXYLL-UHFFFAOYSA-N |
| Molecular Weight |
312.427 g/mol |
| SMILES |
C(C(=O)OC)(Sc1ccccc1)(C(=C)C)Cc1ccccc1 |
| SPLASH |
splash10-0f6x-0971000000-e2386f368dd562a45874 |
| Source of Spectrum |
KC-1986-1952-16 |
| Synonyms |
Methyl 2-benzyl-3-methyl-2-(phenylsulfanyl)-3-butenoate
Methyl 2-benzyl-3-methyl-2-phenylthiobut-3-enoate |
| Wiley ID |
1313468 |
