| SpectraBase Spectrum ID |
JBjgOa9uCfA |
| Name |
2-phenylethanethioic acid S-methyl ester |
| Alternate Name(s) |
Benzeneethanethioic acid, S-methyl ester
Acetic acid, phenylthio-, S-methyl ester
Methyl phenylthioacetate
Methyl phenylthiolacetate
S-Methyl phenylethanethioate
S-methyl 2-phenylethanethioate |
| CAS Registry Number |
5925-74-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C9H10OS |
| InChI |
InChI=1S/C9H10OS/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
| InChIKey |
JZYDYNRKODRXIC-UHFFFAOYSA-N |
| Molecular Weight |
166.238 g/mol |
| SMILES |
C(=O)(Cc1ccccc1)SC |
| SPLASH |
splash10-0006-9100000000-a97a4d8fb448e001228b |
| Source of Spectrum |
KC-57-3299-3 |
| Wiley ID |
1623735 |
