| SpectraBase Compound ID | FOQ8gThDZ49 |
|---|---|
| InChI | InChI=1S/C10H20ClNO2/c1-2-3-4-5-8-12-10(13)14-9-6-7-11/h2-9H2,1H3,(H,12,13) |
| InChIKey | IPDPEFJLEZFYCG-UHFFFAOYSA-N |
| Mol Weight | 221.73 g/mol |
| Molecular Formula | C10H20ClNO2 |
| Exact Mass | 221.118257 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 91qy7mqZM0X |
|---|---|
| Name | Carbonic acid, monoamide, N-hexyl-, 3-chloropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.118256586 u |
| Formula | C10H20ClNO2 |
| InChI | InChI=1S/C10H20ClNO2/c1-2-3-4-5-8-12-10(13)14-9-6-7-11/h2-9H2,1H3,(H,12,13) |
| InChIKey | IPDPEFJLEZFYCG-UHFFFAOYSA-N |
| Molecular Weight | 221.728 g/mol |
| SMILES | C(CCNC(OCCCCl)=O)CCC |