| SpectraBase Compound ID | iV2AeoWrfH |
|---|---|
| InChI | InChI=1S/C11H12ClNS2/c1-2-3-6-14-11-13-9-7-8(12)4-5-10(9)15-11/h4-5,7H,2-3,6H2,1H3 |
| InChIKey | OUSMDWJZPVEPJF-UHFFFAOYSA-N |
| Mol Weight | 257.8 g/mol |
| Molecular Formula | C11H12ClNS2 |
| Exact Mass | 257.009969 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8xkVsTwZ04s |
|---|---|
| Name | 2-(Butylthio)-5-chlorobenzothiazole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.009969438 u |
| Formula | C11H12ClNS2 |
| InChI | InChI=1S/C11H12ClNS2/c1-2-3-6-14-11-13-9-7-8(12)4-5-10(9)15-11/h4-5,7H,2-3,6H2,1H3 |
| InChIKey | OUSMDWJZPVEPJF-UHFFFAOYSA-N |
| Molecular Weight | 257.797 g/mol |
| SMILES | C=12C=C(C=CC1SC(=N2)SCCCC)Cl |