![2-Azabicyclo[3.3.1]nonan-7-one, 2-(2-chloroethyl)-](/api/spectrum/3tLGzgdbF6o/structure.png?h=300&w=458 "2-Azabicyclo[3.3.1]nonan-7-one, 2-(2-chloroethyl)-")
| SpectraBase Compound ID | ElquNMEKZFC |
|---|---|
| InChI | InChI=1S/C10H16ClNO/c11-2-4-12-3-1-8-5-9(12)7-10(13)6-8/h8-9H,1-7H2 |
| InChIKey | PKBGULPFPYJRPV-UHFFFAOYSA-N |
| Mol Weight | 201.7 g/mol |
| Molecular Formula | C10H16ClNO |
| Exact Mass | 201.092042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3tLGzgdbF6o |
|---|---|
| Name | 2-Azabicyclo[3.3.1]nonan-7-one, 2-(2-chloroethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 201.092041838 u |
| Formula | C10H16ClNO |
| InChI | InChI=1S/C10H16ClNO/c11-2-4-12-3-1-8-5-9(12)7-10(13)6-8/h8-9H,1-7H2 |
| InChIKey | PKBGULPFPYJRPV-UHFFFAOYSA-N |
| Molecular Weight | 201.697 g/mol |
| SMILES | C12N(CCC(CC(C2)=O)C1)CCCl |