| SpectraBase Compound ID | DsYQnSt31ZJ |
|---|---|
| InChI | InChI=1S/C9H13NO2S/c1-2-7-13(11,12)9-5-3-8(10)4-6-9/h3-6H,2,7,10H2,1H3 |
| InChIKey | UPYAKDAOBGDGJU-UHFFFAOYSA-N |
| Mol Weight | 199.27 g/mol |
| Molecular Formula | C9H13NO2S |
| Exact Mass | 199.0667 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 | 8gJwRUBYnTp |
|---|---|
| Name | p-(Propylsulfonyl)aniline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.066699835 u |
| Formula | C9H13NO2S |
| InChI | InChI=1S/C9H13NO2S/c1-2-7-13(11,12)9-5-3-8(10)4-6-9/h3-6H,2,7,10H2,1H3 |
| InChIKey | UPYAKDAOBGDGJU-UHFFFAOYSA-N |
| SMILES | NC=1C=CC(=CC1)S(=O)(=O)CCC |