| SpectraBase Spectrum ID |
66IKNgKcDjA |
| Name |
5-(Benzoylthio)pentanoic acid |
| Alternate Name(s) |
5-(benzoylthio)valeric acid
5-(Phenylcarbonylsulfanyl)pentanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14O3S |
| InChI |
InChI=1S/C12H14O3S/c13-11(14)8-4-5-9-16-12(15)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,13,14) |
| InChIKey |
ZYQTXZWVMZZFKI-UHFFFAOYSA-N |
| Molecular Weight |
238.301 g/mol |
| SMILES |
OC(CCCCSC(=O)c1ccccc1)=O |
| SPLASH |
splash10-0ar0-4930000000-810105108920129e1342 |
| Source of Spectrum |
KC-0-1515-20 |
| Wiley ID |
821492 |
