| SpectraBase Compound ID | Ku4DQWmbxRc |
|---|---|
| InChI | InChI=1S/C7H13NO4/c1-5(2)12-7(10)8-4-6(9)11-3/h5H,4H2,1-3H3,(H,8,10) |
| InChIKey | ZXUGSPNUJWTXFU-UHFFFAOYSA-N |
| Mol Weight | 175.18 g/mol |
| Molecular Formula | C7H13NO4 |
| Exact Mass | 175.084458 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6fqfdnCrJZg |
|---|---|
| Name | Glycine, N-isopropyloxycarbonyl-, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 175.084457899 u |
| Formula | C7H13NO4 |
| InChI | InChI=1S/C7H13NO4/c1-5(2)12-7(10)8-4-6(9)11-3/h5H,4H2,1-3H3,(H,8,10) |
| InChIKey | ZXUGSPNUJWTXFU-UHFFFAOYSA-N |
| Molecular Weight | 175.184 g/mol |
| SMILES | C(NC(OC(C)C)=O)C(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977621 |