| SpectraBase Spectrum ID |
9kZihPX0uMh |
| Name |
3-(4-methoxyphenyl)-3-(phenylthio)propanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16O3S |
| InChI |
InChI=1S/C16H16O3S/c1-19-13-9-7-12(8-10-13)15(11-16(17)18)20-14-5-3-2-4-6-14/h2-10,15H,11H2,1H3,(H,17,18) |
| InChIKey |
AALPGXLWTLYBNR-UHFFFAOYSA-N |
| Molecular Weight |
288.361 g/mol |
| SMILES |
OC(CC(Sc1ccccc1)c1ccc(cc1)OC)=O |
| SPLASH |
splash10-000i-0900000000-3bd4b25bbe9a85e28969 |
| Source of Spectrum |
SK-25-1505-2 |
| Synonyms |
3-(4-methoxyphenyl)-3-(phenylthio)propionic acid
3-(4-methoxyphenyl)-3-phenylsulfanylpropanoic acid |
| Wiley ID |
866690 |
