| SpectraBase Compound ID | XK9cWbFrBn |
|---|---|
| InChI | InChI=1S/C11H22ClNO2/c1-3-5-9-13(8-4-2)11(14)15-10-6-7-12/h3-10H2,1-2H3 |
| InChIKey | TXVRHVTYGQHFHQ-UHFFFAOYSA-N |
| Mol Weight | 235.75 g/mol |
| Molecular Formula | C11H22ClNO2 |
| Exact Mass | 235.133907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FWI3vFDXdfP |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-butyl-, 3-chloropropyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.133906650 u |
| Formula | C11H22ClNO2 |
| InChI | InChI=1S/C11H22ClNO2/c1-3-5-9-13(8-4-2)11(14)15-10-6-7-12/h3-10H2,1-2H3 |
| InChIKey | TXVRHVTYGQHFHQ-UHFFFAOYSA-N |
| Molecular Weight | 235.755 g/mol |
| SMILES | C(=O)(OCCCCl)N(CCC)CCCC |