| SpectraBase Compound ID | 9SpTEQXhp16 |
|---|---|
| InChI | InChI=1S/C18H19N/c1-3-10-18(17-13-8-5-9-14-17)19-15(2)16-11-6-4-7-12-16/h1,4-9,11-15,18-19H,10H2,2H3/t15-,18-/m1/s1 |
| InChIKey | KONGCRKWPOIDPV-CRAIPNDOSA-N |
| Mol Weight | 249.36 g/mol |
| Molecular Formula | C18H19N |
| Exact Mass | 249.15175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LIqiOxB8hTO |
|---|---|
| Name | (R,R)- N-(1-Phenyl-3-butynyl)-N-(1-phenylethyl)amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.151749616 u |
| Formula | C18H19N |
| InChI | InChI=1S/C18H19N/c1-3-10-18(17-13-8-5-9-14-17)19-15(2)16-11-6-4-7-12-16/h1,4-9,11-15,18-19H,10H2,2H3/t15-,18-/m1/s1 |
| InChIKey | KONGCRKWPOIDPV-CRAIPNDOSA-N |
| Molecular Weight | 249.357 g/mol |
| SMILES | C=1C=CC=CC1[C@](N[C@](CC#C)(C1=CC=CC=C1)[H])(C)[H] |