| SpectraBase Compound ID | KbaMdFjyjyv |
|---|---|
| InChI | InChI=1S/C9H18N2O2/c1-10(9(12)13-2)11-7-5-3-4-6-8-11/h3-8H2,1-2H3 |
| InChIKey | BQQPNMRCOUDXRB-UHFFFAOYSA-N |
| Mol Weight | 186.25 g/mol |
| Molecular Formula | C9H18N2O2 |
| Exact Mass | 186.136828 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3ke36z4PqCs |
|---|---|
| Name | Tolazamide artifact-1 2me P362 |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.136827826 u |
| Formula | C9H18N2O2 |
| InChI | InChI=1S/C9H18N2O2/c1-10(9(12)13-2)11-7-5-3-4-6-8-11/h3-8H2,1-2H3 |
| InChIKey | BQQPNMRCOUDXRB-UHFFFAOYSA-N |
| Molecular Weight | 186.255 g/mol |
| SMILES | COC(=O)N(N1CCCCCC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.913242 |