| SpectraBase Spectrum ID |
EQ5LCpKqgvh |
| Name |
3-(p-Chlorophenyl)thiobutyric Acid-S-Methyl Ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H13ClOS |
| InChI |
InChI=1S/C11H13ClOS/c1-8(7-11(13)14-2)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3 |
| InChIKey |
UDCCESPZIWIXKC-UHFFFAOYSA-N |
| Molecular Weight |
228.737 g/mol |
| SMILES |
C(CC(c1ccc(cc1)Cl)C)(=O)SC |
| SPLASH |
splash10-004i-0090000000-2cf829b6fd3637eb80bb |
| Source of Spectrum |
C-128-14985-20 |
| Wiley ID |
1701780 |
