| SpectraBase Compound ID | IfxIR4XccmS |
|---|---|
| InChI | InChI=1S/C13H16ClNO/c1-10(2)16-13(4-3-9-15)11-5-7-12(14)8-6-11/h5-8,10,13H,3-4H2,1-2H3 |
| InChIKey | YBAIQXPHJJTGMX-UHFFFAOYSA-N |
| Mol Weight | 237.73 g/mol |
| Molecular Formula | C13H16ClNO |
| Exact Mass | 237.092042 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1r32AdhQyVE |
|---|---|
| Name | 4-(4-Chlorophenyl)-4-isopropoxy-butyronitrile |
| CAS Registry Number | 6940-91-6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C13H16ClNO |
| InChI | InChI=1S/C13H16ClNO/c1-10(2)16-13(4-3-9-15)11-5-7-12(14)8-6-11/h5-8,10,13H,3-4H2,1-2H3 |
| InChIKey | YBAIQXPHJJTGMX-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |