| SpectraBase Compound ID | An5jLVVIs7L |
|---|---|
| InChI | InChI=1S/C12H17NOS/c14-10-6-2-5-9-13-12(15)11-7-3-1-4-8-11/h1,3-4,7-8,14H,2,5-6,9-10H2,(H,13,15) |
| InChIKey | KSRHJNLORWENOT-UHFFFAOYSA-N |
| Mol Weight | 223.33 g/mol |
| Molecular Formula | C12H17NOS |
| Exact Mass | 223.103085 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 | FRTn7H012jQ |
|---|---|
| Name | N-(5-Hydroxypentyl)thiobenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.103085344 u |
| Formula | C12H17NOS |
| InChI | InChI=1S/C12H17NOS/c14-10-6-2-5-9-13-12(15)11-7-3-1-4-8-11/h1,3-4,7-8,14H,2,5-6,9-10H2,(H,13,15) |
| InChIKey | KSRHJNLORWENOT-UHFFFAOYSA-N |
| Molecular Weight | 223.334 g/mol |
| SMILES | C(=S)(C1=CC=CC=C1)NCCCCCO |