| SpectraBase Compound ID | H8cvAbBZY86 |
|---|---|
| InChI | InChI=1S/C9H16N4O/c1-4-12(5-2)8-10-7-13(6-3)9(14)11-8/h7H,4-6H2,1-3H3 |
| InChIKey | HWSYYYOUSJWTQF-UHFFFAOYSA-N |
| Mol Weight | 196.25 g/mol |
| Molecular Formula | C9H16N4O |
| Exact Mass | 196.132411 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AoFwssp2ikJ |
|---|---|
| Name | 5-Azacytosine, N,N,N'-triethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.132411150 u |
| Formula | C9H16N4O |
| InChI | InChI=1S/C9H16N4O/c1-4-12(5-2)8-10-7-13(6-3)9(14)11-8/h7H,4-6H2,1-3H3 |
| InChIKey | HWSYYYOUSJWTQF-UHFFFAOYSA-N |
| Molecular Weight | 196.254 g/mol |
| SMILES | C=1N(C(N=C(N1)N(CC)CC)=O)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.958927 |