![4-[2-Hydroxyethyl)thio]benzoic acid](/api/spectrum/KRKUKMDPvqF/structure.png?h=300&w=458 "4-[2-Hydroxyethyl)thio]benzoic acid")
| SpectraBase Compound ID | 4I1m5BrdiTA |
|---|---|
| InChI | InChI=1S/C9H10O3S/c10-5-6-13-8-3-1-7(2-4-8)9(11)12/h1-4,10H,5-6H2,(H,11,12) |
| InChIKey | NMWAITMVPVIPGG-UHFFFAOYSA-N |
| Mol Weight | 198.24 g/mol |
| Molecular Formula | C9H10O3S |
| Exact Mass | 198.035065 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KRKUKMDPvqF |
|---|---|
| Name | 4-[2-Hydroxyethyl)thio]benzoic acid |
| CAS Registry Number | 7184-99-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H10O3S |
| InChI | InChI=1S/C9H10O3S/c10-5-6-13-8-3-1-7(2-4-8)9(11)12/h1-4,10H,5-6H2,(H,11,12) |
| InChIKey | NMWAITMVPVIPGG-UHFFFAOYSA-N |
| Molecular Weight | 198.236 g/mol |
| SMILES | OC(c1ccc(SCCO)cc1)=O |
| SPLASH | splash10-00kb-4900000000-cbbd636898744feec4da |
| Synonyms | 4-(2-hydroxyethylsulfanyl)benzoic acid |
| Wiley ID | 1483708 |