| SpectraBase Compound ID | CmLK2NdQuS7 |
|---|---|
| InChI | InChI=1S/C9H15NO4/c1-3-5-13-8(11)7-10-9(12)14-6-4-2/h4H,2-3,5-7H2,1H3,(H,10,12) |
| InChIKey | FOYDLRUIWHJNCA-UHFFFAOYSA-N |
| Mol Weight | 201.22 g/mol |
| Molecular Formula | C9H15NO4 |
| Exact Mass | 201.100108 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3uj8IFSoR3g |
|---|---|
| Name | Glycine, N-allyloxycarbonyl-, propyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.100107963 u |
| Formula | C9H15NO4 |
| InChI | InChI=1S/C9H15NO4/c1-3-5-13-8(11)7-10-9(12)14-6-4-2/h4H,2-3,5-7H2,1H3,(H,10,12) |
| InChIKey | FOYDLRUIWHJNCA-UHFFFAOYSA-N |
| Molecular Weight | 201.222 g/mol |
| SMILES | C=CCOC(NCC(OCCC)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.866743 |