| SpectraBase Compound ID | 4U5q7olVuNs |
|---|---|
| InChI | InChI=1S/C16H30N2O5/c1-7-8-9-10-11-23-15(20)13(3)17(4)14(19)12(2)18(5)16(21)22-6/h12-13H,7-11H2,1-6H3 |
| InChIKey | CGKIAOUMCOMFLG-UHFFFAOYSA-N |
| Mol Weight | 330.43 g/mol |
| Molecular Formula | C16H30N2O5 |
| Exact Mass | 330.215472 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1TQwKD4Xzg6 |
|---|---|
| Name | Alanylalanine, N,N'-dimethyl-N'-methoxycarbonyl-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.215472069 u |
| Formula | C16H30N2O5 |
| InChI | InChI=1S/C16H30N2O5/c1-7-8-9-10-11-23-15(20)13(3)17(4)14(19)12(2)18(5)16(21)22-6/h12-13H,7-11H2,1-6H3 |
| InChIKey | CGKIAOUMCOMFLG-UHFFFAOYSA-N |
| Molecular Weight | 330.425 g/mol |
| SMILES | CCCCCCOC(C(N(C(=O)C(N(C(OC)=O)C)C)C)C)=O |