SpectraBase Spectrum ID |
IBk6F1ZPuts |
Name |
2-[[1-Fluoro-2-(4-morpholinyl)ethyl]sulfonyl]benzothiazole |
Appearance |
White solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H15FN2O3S2 |
InChI |
InChI=1S/C13H15FN2O3S2/c14-12(9-16-5-7-19-8-6-16)21(17,18)13-15-10-3-1-2-4-11(10)20-13/h1-4,12H,5-9H2 |
InChIKey |
DJXOYIPGHSSLDS-UHFFFAOYSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.202301793 |
Molecular Weight |
330.392 g/mol |
Quality |
44 |
SMILES |
C1=CC2=C(C=C1)SC(=N2)S(C(CN1CCOCC1)F)(=O)=O |
SPLASH |
splash10-001l-0965000000-107e749448bc9cd2f0a1 |
Source of Spectrum |
QE-29-SM8-2a (DOI: 10.1002/chem.202301793) |
Wiley ID |
1912043 |