| SpectraBase Compound ID | 2JJciGLNuJr |
|---|---|
| InChI | InChI=1S/C5H9NO2/c1-3-4-6-5(7)8-2/h3H,1,4H2,2H3,(H,6,7) |
| InChIKey | RGVMJBAUCBSEGO-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 | BlVGh8LFQDM |
|---|---|
| Name | Methyl allylcarbamate |
| 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/c1-3-4-6-5(7)8-2/h3H,1,4H2,2H3,(H,6,7) |
| InChIKey | RGVMJBAUCBSEGO-UHFFFAOYSA-N |
| Molecular Weight | 115.132 g/mol |
| SMILES | C(=O)(NCC=C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915471 |