| SpectraBase Compound ID | F5ZKsmcMbPn |
|---|---|
| InChI | InChI=1S/C12H11NO/c1-13-9-10(5-4-8-14)11-6-2-3-7-12(11)13/h2-9H,1H3/b5-4+ |
| InChIKey | INFQBOHNRDDFTA-SNAWJCMRSA-N |
| Mol Weight | 185.23 g/mol |
| Molecular Formula | C12H11NO |
| Exact Mass | 185.084064 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 | JNBfEbnZjn3 |
|---|---|
| Name | (E)-3-(1-Methyl-1H-indol-3-yl)propenal |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 185.084063977 u |
| Formula | C12H11NO |
| InChI | InChI=1S/C12H11NO/c1-13-9-10(5-4-8-14)11-6-2-3-7-12(11)13/h2-9H,1H3/b5-4+ |
| InChIKey | INFQBOHNRDDFTA-SNAWJCMRSA-N |
| Molecular Weight | 185.226 g/mol |
| SMILES | C(\C=C\C1=CN(C=2C=CC=CC12)C)=O |