| SpectraBase Compound ID | 8AkITml41bV |
|---|---|
| InChI | InChI=1S/C17H23N/c1-15-10-12-16(13-11-15)7-6-14-18(2)17-8-4-3-5-9-17/h10-13,17H,3-5,8-9,14H2,1-2H3 |
| InChIKey | NCLRCWSZDQVPNJ-UHFFFAOYSA-N |
| Mol Weight | 241.38 g/mol |
| Molecular Formula | C17H23N |
| Exact Mass | 241.18305 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A2uGNBWxcT3 |
|---|---|
| Name | N-Methyl-N-(3-(p-tolyl)prop-2-yn-1-yl)cyclohexanamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 241.183049745 u |
| Formula | C17H23N |
| InChI | InChI=1S/C17H23N/c1-15-10-12-16(13-11-15)7-6-14-18(2)17-8-4-3-5-9-17/h10-13,17H,3-5,8-9,14H2,1-2H3 |
| InChIKey | NCLRCWSZDQVPNJ-UHFFFAOYSA-N |
| Molecular Weight | 241.378 g/mol |
| SMILES | C=1(C=CC(C#CCN(C2CCCCC2)C)=CC1)C |