| SpectraBase Spectrum ID |
2SG5ZiHNNf6 |
| Name |
tert-Butyl 2-[1-oxido-1-(piperidin-1-yl)-3H-1.lambda.4-benzo[d]isothiazol-3-yl]acetate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
350.166413876 u |
| Formula |
C18H26N2O3S |
| InChI |
InChI=1S/C18H26N2O3S/c1-18(2,3)23-17(21)13-15-14-9-5-6-10-16(14)24(22,19-15)20-11-7-4-8-12-20/h5-6,9-10,15H,4,7-8,11-13H2,1-3H3 |
| InChIKey |
VZTSLRAIZNIAQT-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201900920 |
| Molecular Weight |
350.477 g/mol |
| Reported Formula |
C18H26N2O3S |
| SMILES |
C1=CC2=C(C=C1)C(N=S2(N1CCCCC1)=O)CC(OC(C)(C)C)=O |
| SPLASH |
splash10-0f8i-9367000000-c1a6cc578ee677217743 |
| Sample Comments |
Minor, dr = 2:3 |
| Source of Spectrum |
QE-25-SM15-3ad (DOI: 10.1002/chem.201900920) |
| Wiley ID |
1891443 |
![tert-Butyl 2-[1-oxido-1-(piperidin-1-yl)-3H-1.lambda.4-benzo[d]isothiazol-3-yl]acetate](/api/spectrum/2SG5ZiHNNf6/structure.png?h=300&w=458 "tert-Butyl 2-[1-oxido-1-(piperidin-1-yl)-3H-1.lambda.4-benzo[d]isothiazol-3-yl]acetate")
