| SpectraBase Compound ID | A0Q643WRXxe |
|---|---|
| InChI | InChI=1S/C11H20ClNO/c1-3-9-13(10-4-2)11(14)7-5-6-8-12/h3H,1,4-10H2,2H3 |
| InChIKey | PMRKCFPBBSNQTJ-UHFFFAOYSA-N |
| Mol Weight | 217.74 g/mol |
| Molecular Formula | C11H20ClNO |
| Exact Mass | 217.123342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EvjPlo1A4f8 |
|---|---|
| Name | Valeramide, 5-chloro-N-allyl-N-propyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.123341967 u |
| Formula | C11H20ClNO |
| InChI | InChI=1S/C11H20ClNO/c1-3-9-13(10-4-2)11(14)7-5-6-8-12/h3H,1,4-10H2,2H3 |
| InChIKey | PMRKCFPBBSNQTJ-UHFFFAOYSA-N |
| Molecular Weight | 217.740 g/mol |
| SMILES | C(N(CCC)CC=C)(=O)CCCCCl |