| SpectraBase Spectrum ID |
4UAIfsbfmRM |
| Name |
2-(3-pyridinesulfanyl)-5-benzothiazolyl 2,2-dimethylpropanoate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H16N2O2S2 |
| InChI |
InChI=1S/C17H16N2O2S2/c1-17(2,3)15(20)21-11-6-7-14-13(9-11)19-16(23-14)22-12-5-4-8-18-10-12/h4-10H,1-3H3 |
| InChIKey |
QXUDZEQENHKKIS-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Molecular Weight |
344.447 g/mol |
| Reported Formula |
C17H16N2O2S2 |
| SMILES |
c1ncccc1Sc1sc2c(n1)cc(cc2)OC(C(C)(C)C)=O |
| SPLASH |
splash10-0a4i-9062000000-bb5268fc4d1d9813099e |
| Source of Spectrum |
WO2021070957A1 |
| Thin-Layer Chromatography |
Rf = 0.5 (hexane/ethyl acetate, 2:1) |
| Wiley ID |
1879989 |
