| SpectraBase Compound ID | GO2ZTFxYzF5 |
|---|---|
| InChI | InChI=1S/C14H14BrN3S/c1-18-8-2-3-13(18)17-14-16-12(9-19-14)10-4-6-11(15)7-5-10/h4-7,9H,2-3,8H2,1H3/b17-13+ |
| InChIKey | OWDMJIMSLJGDNT-GHRIWEEISA-N |
| Mol Weight | 336.25 g/mol |
| Molecular Formula | C14H14BrN3S |
| Exact Mass | 335.009182 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 | 8vG35Fnl8Ri |
|---|---|
| Name | Thiazole, 4-(4-bromophenyl)-2-(1-methylpyrrolidin-2-ylideneamino)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 335.009181637 u |
| Formula | C14H14BrN3S |
| InChI | InChI=1S/C14H14BrN3S/c1-18-8-2-3-13(18)17-14-16-12(9-19-14)10-4-6-11(15)7-5-10/h4-7,9H,2-3,8H2,1H3/b17-13+ |
| InChIKey | OWDMJIMSLJGDNT-GHRIWEEISA-N |
| Molecular Weight | 336.251 g/mol |
| SMILES | C=1(\N=C/2CCCN2C)SC=C(C2=CC=C(C=C2)Br)N1 |