| SpectraBase Compound ID | BN0Ikf5nusu |
|---|---|
| InChI | InChI=1S/C9H16ClNO4/c1-2-6-14-8(12)3-5-11-9(13)15-7-4-10/h2-7H2,1H3,(H,11,13) |
| InChIKey | JDLCSXLUBDJAIL-UHFFFAOYSA-N |
| Mol Weight | 237.68 g/mol |
| Molecular Formula | C9H16ClNO4 |
| Exact Mass | 237.076786 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 55RI9YPnOss |
|---|---|
| Name | .beta.-Alanine, N-(2-chloroethoxycarbonyl)-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.076785695 u |
| Formula | C9H16ClNO4 |
| InChI | InChI=1S/C9H16ClNO4/c1-2-6-14-8(12)3-5-11-9(13)15-7-4-10/h2-7H2,1H3,(H,11,13) |
| InChIKey | JDLCSXLUBDJAIL-UHFFFAOYSA-N |
| Molecular Weight | 237.683 g/mol |
| SMILES | CCCOC(=O)CCNC(OCCCl)=O |