| SpectraBase Compound ID | IsJnTq4h8gF |
|---|---|
| InChI | InChI=1S/C13H24ClNO4/c1-4-5-6-9-18-12(16)11(2)15(3)13(17)19-10-7-8-14/h11H,4-10H2,1-3H3 |
| InChIKey | GGBACCKOAOQSJR-UHFFFAOYSA-N |
| Mol Weight | 293.79 g/mol |
| Molecular Formula | C13H24ClNO4 |
| Exact Mass | 293.139386 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CLM4kgKqEl5 |
|---|---|
| Name | dl-Alanine, N-methyl-N-(3-chloropropoxycarbonyl)-, pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 293.139385953 u |
| Formula | C13H24ClNO4 |
| InChI | InChI=1S/C13H24ClNO4/c1-4-5-6-9-18-12(16)11(2)15(3)13(17)19-10-7-8-14/h11H,4-10H2,1-3H3 |
| InChIKey | GGBACCKOAOQSJR-UHFFFAOYSA-N |
| Molecular Weight | 293.791 g/mol |
| SMILES | CC(N(C)C(=O)OCCCCl)C(=O)OCCCCC |