| SpectraBase Compound ID | JVxIpFJBhkQ |
|---|---|
| InChI | InChI=1S/C12H13NO2/c14-12(13-8-4-5-9-13)15-10-11-6-2-1-3-7-11/h1-4,6-8H,5,9-10H2 |
| InChIKey | ZNLOEFQSAKKFGT-UHFFFAOYSA-N |
| Mol Weight | 203.24 g/mol |
| Molecular Formula | C12H13NO2 |
| Exact Mass | 203.094629 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3y78h1R8ATX |
|---|---|
| Name | 1-(Benzyloxycarbonyl)-2-pyrroline |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 203.094628661 u |
| Formula | C12H13NO2 |
| InChI | InChI=1S/C12H13NO2/c14-12(13-8-4-5-9-13)15-10-11-6-2-1-3-7-11/h1-4,6-8H,5,9-10H2 |
| InChIKey | ZNLOEFQSAKKFGT-UHFFFAOYSA-N |
| Molecular Weight | 203.241 g/mol |
| SMILES | C=1N(CCC1)C(=O)OCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963761 |