| SpectraBase Compound ID | LyLVVBa67jb |
|---|---|
| InChI | InChI=1S/C11H10N2O/c1-14-10-4-2-3-9-8(5-6-12)7-13-11(9)10/h2-4,7,13H,5H2,1H3 |
| InChIKey | VESSMVSYPZPDMA-UHFFFAOYSA-N |
| Mol Weight | 186.21 g/mol |
| Molecular Formula | C11H10N2O |
| Exact Mass | 186.079313 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CaqxhVK7BdS |
|---|---|
| Name | 3-Indoleacetonitrile, 7-methoxy- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.079312949 u |
| Formula | C11H10N2O |
| InChI | InChI=1S/C11H10N2O/c1-14-10-4-2-3-9-8(5-6-12)7-13-11(9)10/h2-4,7,13H,5H2,1H3 |
| InChIKey | VESSMVSYPZPDMA-UHFFFAOYSA-N |
| Molecular Weight | 186.214 g/mol |
| SMILES | C12=C(C=CC=C2OC)C(CC#N)=CN1 |