| SpectraBase Compound ID | DqvWQyWcLMg |
|---|---|
| InChI | InChI=1S/C5H9NO2/c1-8-4(7)5(6)2-3-5/h2-3,6H2,1H3 |
| InChIKey | CSHMCEYIMFSLSS-UHFFFAOYSA-N |
| Mol Weight | 115.13 g/mol |
| Molecular Formula | C5H9NO2 |
| Exact Mass | 115.063329 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1C3axjLAD3M |
|---|---|
| Name | Methyl 1-aminocyclopropanecarboxylate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 115.063328532 u |
| Formula | C5H9NO2 |
| InChI | InChI=1S/C5H9NO2/c1-8-4(7)5(6)2-3-5/h2-3,6H2,1H3 |
| InChIKey | CSHMCEYIMFSLSS-UHFFFAOYSA-N |
| Molecular Weight | 115.132 g/mol |
| SMILES | C1(CC1)(N)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.875033 |