| SpectraBase Compound ID | 6tlEOD7Elhf |
|---|---|
| InChI | InChI=1S/C12H15NO/c13-12(9-5-4-8-11(12)14)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,13H2 |
| InChIKey | IXDGGSSUYSFGOK-UHFFFAOYSA-N |
| Mol Weight | 189.26 g/mol |
| Molecular Formula | C12H15NO |
| Exact Mass | 189.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4z8EkeXa33A |
|---|---|
| Name | Deschloronorketamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 189.115364106 u |
| Formula | C12H15NO |
| InChI | InChI=1S/C12H15NO/c13-12(9-5-4-8-11(12)14)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,13H2 |
| InChIKey | IXDGGSSUYSFGOK-UHFFFAOYSA-N |
| Molecular Weight | 189.258 g/mol |
| SMILES | C1(C=2C=CC=CC2)(C(CCCC1)=O)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.947051 |