| SpectraBase Spectrum ID |
4JwCPnxQjXI |
| Name |
2-(isopropylthio)benzoic acid isopropyl ester |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O2S |
| InChI |
InChI=1S/C13H18O2S/c1-9(2)15-13(14)11-7-5-6-8-12(11)16-10(3)4/h5-10H,1-4H3 |
| InChIKey |
VLEQQMYTBOCWBD-UHFFFAOYSA-N |
| Molecular Weight |
238.345 g/mol |
| SMILES |
C(c1c(SC(C)C)cccc1)(OC(C)C)=O |
| SPLASH |
splash10-000i-0920000000-932b2124e965896123c2 |
| Source of Spectrum |
KC-0-157-14 |
| Synonyms |
2-(propan-2-ylthio)benzoic acid propan-2-yl ester
Propan-2-yl 2-propan-2-ylsulfanylbenzoate |
| Wiley ID |
780441 |
