| SpectraBase Compound ID | Gp4XK8xWbpT |
|---|---|
| InChI | InChI=1S/C7H13N3O3/c1-2-13-7(11)9-3-5-10(8-12)6-4-9/h2-6H2,1H3 |
| InChIKey | OYHRVILJSHWJAE-UHFFFAOYSA-N |
| Mol Weight | 187.2 g/mol |
| Molecular Formula | C7H13N3O3 |
| Exact Mass | 187.095691 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | A9fTufeOgIH |
|---|---|
| Name | 1-Piperazinecarboxylic acid, 4-nitroso- ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.095691288 u |
| Formula | C7H13N3O3 |
| InChI | InChI=1S/C7H13N3O3/c1-2-13-7(11)9-3-5-10(8-12)6-4-9/h2-6H2,1H3 |
| InChIKey | OYHRVILJSHWJAE-UHFFFAOYSA-N |
| Molecular Weight | 187.199 g/mol |
| SMILES | C1CN(CCN1N=O)C(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.941163 |