| SpectraBase Compound ID | 3B6A5b7HF6v |
|---|---|
| InChI | InChI=1S/C11H14N2O3/c12-9(11(16)13-7-10(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,16)(H,14,15)/t9-/m0/s1 |
| InChIKey | GLUBLISJVJFHQS-VIFPVBQESA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C11H14N2O3 |
| Exact Mass | 222.100442 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DfnzVj71YUu |
|---|---|
| Name | L-Phenylalanyl-glycine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.100442316 u |
| Formula | C11H14N2O3 |
| InChI | InChI=1S/C11H14N2O3/c12-9(11(16)13-7-10(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,16)(H,14,15)/t9-/m0/s1 |
| InChIKey | GLUBLISJVJFHQS-VIFPVBQESA-N |
| Molecular Weight | 222.244 g/mol |
| Nominal Mass | 222 u |
| SMILES | C1(=CC=CC=C1)C[C@](N)(C(NCC(O)=O)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.884925 |