| SpectraBase Compound ID | INWz84sSXf4 |
|---|---|
| InChI | InChI=1S/C16H28N2O5/c1-3-5-10-22-15(20)13-8-7-9-18(13)14(19)12-17-16(21)23-11-6-4-2/h13H,3-12H2,1-2H3,(H,17,21) |
| InChIKey | UPABYPJZXHFTPB-UHFFFAOYSA-N |
| Mol Weight | 328.41 g/mol |
| Molecular Formula | C16H28N2O5 |
| Exact Mass | 328.199822 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4a6J3rZ00yG |
|---|---|
| Name | Glycyl-L-proline, N-butoxycarbonyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.199822005 u |
| Formula | C16H28N2O5 |
| InChI | InChI=1S/C16H28N2O5/c1-3-5-10-22-15(20)13-8-7-9-18(13)14(19)12-17-16(21)23-11-6-4-2/h13H,3-12H2,1-2H3,(H,17,21) |
| InChIKey | UPABYPJZXHFTPB-UHFFFAOYSA-N |
| Molecular Weight | 328.409 g/mol |
| SMILES | C(NC(OCCCC)=O)C(=O)N1CCCC1C(OCCCC)=O |