| SpectraBase Compound ID | HYbZKt2kqXR |
|---|---|
| InChI | InChI=1S/C12H11N3S3/c13-12(16)15-9(11-4-2-6-18-11)7-8(14-15)10-3-1-5-17-10/h1-6,9H,7H2,(H2,13,16) |
| InChIKey | XWHXWVILQHORFC-UHFFFAOYSA-N |
| Mol Weight | 293.42 g/mol |
| Molecular Formula | C12H11N3S3 |
| Exact Mass | 293.011511 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 | 1BpuPbnAUyz |
|---|---|
| Name | 1-Thiocarbamoyl-3,5-di-(2-thienyl)-2-pyrazoline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.011510888 u |
| Formula | C12H11N3S3 |
| InChI | InChI=1S/C12H11N3S3/c13-12(16)15-9(11-4-2-6-18-11)7-8(14-15)10-3-1-5-17-10/h1-6,9H,7H2,(H2,13,16) |
| InChIKey | XWHXWVILQHORFC-UHFFFAOYSA-N |
| Molecular Weight | 293.421 g/mol |
| SMILES | C1(=NN(C(C1)C1=CC=CS1)C(N)=S)C1=CC=CS1 |