| SpectraBase Compound ID | HxgMdxyC7cQ |
|---|---|
| InChI | InChI=1S/C13H18ClNO/c1-7(16)15-13(14)12-10-3-8-2-9(5-10)6-11(12)4-8/h8-11H,2-6H2,1H3,(H,15,16)/b13-12-/t8-,9+,10-,11+ |
| InChIKey | CBJIDWKCWRZXNL-YGGUWYPNSA-N |
| Mol Weight | 239.75 g/mol |
| Molecular Formula | C13H18ClNO |
| Exact Mass | 239.107692 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7udzgehbU7R |
|---|---|
| Name | ROTAMER-#1 |
| CAS Registry Number | 128445-63-6 |
| Compound Number | 6C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C13H18ClNO |
| InChI | InChI=1S/C13H18ClNO/c1-7(16)15-13(14)12-10-3-8-2-9(5-10)6-11(12)4-8/h8-11H,2-6H2,1H3,(H,15,16)/b13-12-/t8-,9+,10-,11+ |
| InChIKey | CBJIDWKCWRZXNL-YGGUWYPNSA-N |
| Literature Reference Author | S.MEIER,E.U.WUERTHWEIN |
| Literature Reference Citation | CHEM.BER.,123,2339(1990) |
| Literature Reference DOI | 10.1002/cber.19901231218 |
| Molecular Weight | 239.745 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED10460 |