| SpectraBase Spectrum ID |
1dia4TTvnGk |
| Name |
2-[(1-Fluoro-2-pyrrolidin-1-ylethyl)sulfonyl]-1,3-benzothiazole |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15FN2O2S2 |
| InChI |
InChI=1S/C13H15FN2O2S2/c14-12(9-16-7-3-4-8-16)20(17,18)13-15-10-5-1-2-6-11(10)19-13/h1-2,5-6,12H,3-4,7-9H2 |
| InChIKey |
XWSMTSMNUVUORW-UHFFFAOYSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202301793 |
| Molecular Weight |
314.393 g/mol |
| Quality |
68 |
| SMILES |
C1=CC2=C(C=C1)SC(=N2)S(C(CN1CCCC1)F)(=O)=O |
| SPLASH |
splash10-014l-1897000000-1c7c6006e56123d4327e |
| Source of Spectrum |
QE-29-SM8-2b (DOI: 10.1002/chem.202301793) |
| Wiley ID |
1912044 |
![2-[(1-Fluoro-2-pyrrolidin-1-ylethyl)sulfonyl]-1,3-benzothiazole](/api/spectrum/1dia4TTvnGk/structure.png?h=300&w=458 "2-[(1-Fluoro-2-pyrrolidin-1-ylethyl)sulfonyl]-1,3-benzothiazole")
