| SpectraBase Compound ID | BaR5McjoUW9 |
|---|---|
| InChI | InChI=1S/C13H17N3O3S/c1-2-20(17,18)16-9-7-15(8-10-16)13-14-11-5-3-4-6-12(11)19-13/h3-6H,2,7-10H2,1H3 |
| InChIKey | DLPZUDWLUFDGAE-UHFFFAOYSA-N |
| Mol Weight | 295.36 g/mol |
| Molecular Formula | C13H17N3O3S |
| Exact Mass | 295.099063 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BXtf4AeGHQR |
|---|---|
| Name | Benzooxazole, 2-(4-ethanesulfonylpiperazin-1-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.099062590 u |
| Formula | C13H17N3O3S |
| InChI | InChI=1S/C13H17N3O3S/c1-2-20(17,18)16-9-7-15(8-10-16)13-14-11-5-3-4-6-12(11)19-13/h3-6H,2,7-10H2,1H3 |
| InChIKey | DLPZUDWLUFDGAE-UHFFFAOYSA-N |
| SMILES | C12=CC=CC=C2N=C(O1)N1CCN(CC1)S(CC)(=O)=O |