| SpectraBase Compound ID | H7DiNH77owM |
|---|---|
| InChI | InChI=1S/2C12H16N2O3/c2*1-8(13)11(15)14-10(12(16)17)7-9-5-3-2-4-6-9/h2*2-6,8,10H,7,13H2,1H3,(H,14,15)(H,16,17)/t2*8?,10-/m11/s1 |
| InChIKey | ZHQQWRJKRWAJHN-IUSNRNFUSA-N |
| Mol Weight | 472.54 g/mol |
| Molecular Formula | C24H32N4O6 |
| Exact Mass | 472.232185 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E8wnMcOkiWr |
|---|---|
| Name | dl-Alanyl-L-phenylalanine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 472.232184760 u |
| Formula | C24H32N4O6 |
| InChI | InChI=1S/2C12H16N2O3/c2*1-8(13)11(15)14-10(12(16)17)7-9-5-3-2-4-6-9/h2*2-6,8,10H,7,13H2,1H3,(H,14,15)(H,16,17)/t2*8?,10-/m11/s1 |
| InChIKey | ZHQQWRJKRWAJHN-IUSNRNFUSA-N |
| Molecular Weight | 472.542 g/mol |
| Nominal Mass | 472 u |
| SMILES | C(N)(C(N[C@@](C(O)=O)(CC1=CC=CC=C1)[H])=O)C.C(N)(C(N[C@@](C(O)=O)(CC1=CC=CC=C1)[H])=O)C |