| SpectraBase Compound ID | LSmCKYYI3R8 |
|---|---|
| InChI | InChI=1S/C13H12N2O/c16-8-6-12-13-10(5-7-14-12)9-3-1-2-4-11(9)15-13/h1-5,7,15-16H,6,8H2 |
| InChIKey | DQWCOPIJKAFODS-UHFFFAOYSA-N |
| Mol Weight | 212.25 g/mol |
| Molecular Formula | C13H12N2O |
| Exact Mass | 212.094963 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GrLpeC5e9CU |
|---|---|
| Name | 1-[2'-(Hydroxyethyl)-1.beta.-carboline |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.094963013 u |
| Formula | C13H12N2O |
| InChI | InChI=1S/C13H12N2O/c16-8-6-12-13-10(5-7-14-12)9-3-1-2-4-11(9)15-13/h1-5,7,15-16H,6,8H2 |
| InChIKey | DQWCOPIJKAFODS-UHFFFAOYSA-N |
| Molecular Weight | 212.252 g/mol |
| SMILES | C1=2NC=3C(C2C=CN=C1CCO)=CC=CC3 |