| SpectraBase Compound ID | 30ij74gbsL1 |
|---|---|
| InChI | InChI=1S/C15H23ClN2O5/c1-2-22-14(20)12-6-4-8-17(12)13(19)11-5-3-9-18(11)15(21)23-10-7-16/h11-12H,2-10H2,1H3 |
| InChIKey | UNJFABFJNMGJFE-UHFFFAOYSA-N |
| Mol Weight | 346.81 g/mol |
| Molecular Formula | C15H23ClN2O5 |
| Exact Mass | 346.12955 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A8i6E2XaOgw |
|---|---|
| Name | D-Prolyl-D-proline, N-(2-chloroethoxycarbonyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.129549544 u |
| Formula | C15H23ClN2O5 |
| InChI | InChI=1S/C15H23ClN2O5/c1-2-22-14(20)12-6-4-8-17(12)13(19)11-5-3-9-18(11)15(21)23-10-7-16/h11-12H,2-10H2,1H3 |
| InChIKey | UNJFABFJNMGJFE-UHFFFAOYSA-N |
| Molecular Weight | 346.811 g/mol |
| SMILES | C1(N(CCC1)C(=O)C1N(C(OCCCl)=O)CCC1)C(OCC)=O |