| SpectraBase Compound ID | 50ML9kpV8pF |
|---|---|
| InChI | InChI=1S/C15H22ClNO/c1-3-5-6-15(18)17-14(4-2)11-12-7-9-13(16)10-8-12/h7-10,14H,3-6,11H2,1-2H3,(H,17,18) |
| InChIKey | RIWKGSQJIHKIAZ-UHFFFAOYSA-N |
| Mol Weight | 267.8 g/mol |
| Molecular Formula | C15H22ClNO |
| Exact Mass | 267.138992 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8QxCLf8IPD7 |
|---|---|
| Name | 4-cab Pent |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.138992031 u |
| Formula | C15H22ClNO |
| InChI | InChI=1S/C15H22ClNO/c1-3-5-6-15(18)17-14(4-2)11-12-7-9-13(16)10-8-12/h7-10,14H,3-6,11H2,1-2H3,(H,17,18) |
| InChIKey | RIWKGSQJIHKIAZ-UHFFFAOYSA-N |
| Molecular Weight | 267.800 g/mol |
| SMILES | C(NC(CCCC)=O)(CC1=CC=C(C=C1)Cl)CC |