| SpectraBase Compound ID | HijXw4bU31a |
|---|---|
| InChI | InChI=1S/C16H11N3S/c1-2-4-14-12(3-1)13(9-18-14)15-10-20-16(19-15)11-5-7-17-8-6-11/h1-10,18H |
| InChIKey | DQLDIESPWIFJFQ-UHFFFAOYSA-N |
| Mol Weight | 277.34 g/mol |
| Molecular Formula | C16H11N3S |
| Exact Mass | 277.067369 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 | 5Gp846gHAd7 |
|---|---|
| Name | 1H-Indole, 3-(2-pyridin-4-yl-thiazol-4-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.067368540 u |
| Formula | C16H11N3S |
| InChI | InChI=1S/C16H11N3S/c1-2-4-14-12(3-1)13(9-18-14)15-10-20-16(19-15)11-5-7-17-8-6-11/h1-10,18H |
| InChIKey | DQLDIESPWIFJFQ-UHFFFAOYSA-N |
| Molecular Weight | 277.345 g/mol |
| SMILES | C1(C=2N=C(C3=CC=NC=C3)SC2)=CNC=2C1=CC=CC2 |