| SpectraBase Spectrum ID |
1GO5oB2NMb5 |
| Name |
Ethyl 2-[1-oxido-1-(piperidin-1-yl)-3H-1.lambda.4-benzo[d]isothiazol-3-yl]acetate |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.135113747 u |
| Formula |
C16H22N2O3S |
| InChI |
InChI=1S/C16H22N2O3S/c1-2-21-16(19)12-14-13-8-4-5-9-15(13)22(20,17-14)18-10-6-3-7-11-18/h4-5,8-9,14H,2-3,6-7,10-12H2,1H3 |
| InChIKey |
SYQHFXHEMFSOHG-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201900920 |
| Molecular Weight |
322.423 g/mol |
| Quality |
164 |
| Reported Formula |
C16H22N2O3S |
| SMILES |
C1=CC2=C(C=C1)C(N=S2(N1CCCCC1)=O)CC(OCC)=O |
| SPLASH |
splash10-0080-9584000000-c88677033243af26c661 |
| Sample Comments |
dr = 5:4 |
| Source of Spectrum |
QE-25-SM15-3ac (DOI: 10.1002/chem.201900920) |
| Wiley ID |
1891441 |
![Ethyl 2-[1-oxido-1-(piperidin-1-yl)-3H-1.lambda.4-benzo[d]isothiazol-3-yl]acetate](/api/spectrum/1GO5oB2NMb5/structure.png?h=300&w=458 "Ethyl 2-[1-oxido-1-(piperidin-1-yl)-3H-1.lambda.4-benzo[d]isothiazol-3-yl]acetate")
