| SpectraBase Compound ID | HJI8T4GXet2 |
|---|---|
| InChI | InChI=1S/C11H20ClNO4/c1-9(2)4-3-6-16-10(14)8-13-11(15)17-7-5-12/h9H,3-8H2,1-2H3,(H,13,15) |
| InChIKey | QDZQCXYLZNEJBP-UHFFFAOYSA-N |
| Mol Weight | 265.74 g/mol |
| Molecular Formula | C11H20ClNO4 |
| Exact Mass | 265.108086 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Bz4rfY6vcf |
|---|---|
| Name | Glycine, N-(2-chloroethoxycarbonyl)-, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 265.108085824 u |
| Formula | C11H20ClNO4 |
| InChI | InChI=1S/C11H20ClNO4/c1-9(2)4-3-6-16-10(14)8-13-11(15)17-7-5-12/h9H,3-8H2,1-2H3,(H,13,15) |
| InChIKey | QDZQCXYLZNEJBP-UHFFFAOYSA-N |
| Molecular Weight | 265.737 g/mol |
| SMILES | CC(C)CCCOC(CNC(OCCCl)=O)=O |