| SpectraBase Compound ID | 6LciHOJFXR0 |
|---|---|
| InChI | InChI=1S/C18H22ClNO/c19-14-11-9-13(10-12-14)18(21)16-7-4-8-17(16)20-15-5-2-1-3-6-15/h9-12,15,20H,1-8H2 |
| InChIKey | NPNSDOUQURGWDL-UHFFFAOYSA-N |
| Mol Weight | 303.83 g/mol |
| Molecular Formula | C18H22ClNO |
| Exact Mass | 303.138992 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8CYawhujcUP |
|---|---|
| Name | 1-(4-Chlorobenzoyl)-2-cyclohexylaminocyclopentene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.138992031 u |
| Formula | C18H22ClNO |
| InChI | InChI=1S/C18H22ClNO/c19-14-11-9-13(10-12-14)18(21)16-7-4-8-17(16)20-15-5-2-1-3-6-15/h9-12,15,20H,1-8H2 |
| InChIKey | NPNSDOUQURGWDL-UHFFFAOYSA-N |
| SMILES | C1(=C(CCC1)NC1CCCCC1)C(C=1C=CC(=CC1)Cl)=O |