| SpectraBase Compound ID | 34Qz8FM84EL |
|---|---|
| InChI | InChI=1S/C10H11NO2/c12-10(11-6-7-11)13-8-9-4-2-1-3-5-9/h1-5H,6-8H2 |
| InChIKey | PFXWAZGPFWJKBF-UHFFFAOYSA-N |
| Mol Weight | 177.2 g/mol |
| Molecular Formula | C10H11NO2 |
| Exact Mass | 177.078979 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KqYkRmWg1Ot |
|---|---|
| Name | (Phenylmethyl) aziridine-1-carboxylate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.078978596 u |
| Formula | C10H11NO2 |
| InChI | InChI=1S/C10H11NO2/c12-10(11-6-7-11)13-8-9-4-2-1-3-5-9/h1-5H,6-8H2 |
| InChIKey | PFXWAZGPFWJKBF-UHFFFAOYSA-N |
| Molecular Weight | 177.203 g/mol |
| SMILES | C1N(C1)C(=O)OCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.959258 |