| SpectraBase Compound ID | 46xKsQnq5Ue |
|---|---|
| InChI | InChI=1S/C21H29N/c1-3-4-7-12-20(19-13-8-5-9-14-19)17-18-22(2)21-15-10-6-11-16-21/h5-6,8-11,13-16,20H,3-4,7,12,17-18H2,1-2H3 |
| InChIKey | BBUJQGNKDSIOCB-UHFFFAOYSA-N |
| Mol Weight | 295.47 g/mol |
| Molecular Formula | C21H29N |
| Exact Mass | 295.23 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6WZuP4O0krM |
|---|---|
| Name | Methyl phenyl 3-phenyloctyl amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.229999938 u |
| Formula | C21H29N |
| InChI | InChI=1S/C21H29N/c1-3-4-7-12-20(19-13-8-5-9-14-19)17-18-22(2)21-15-10-6-11-16-21/h5-6,8-11,13-16,20H,3-4,7,12,17-18H2,1-2H3 |
| InChIKey | BBUJQGNKDSIOCB-UHFFFAOYSA-N |
| SMILES | C(N(C1=CC=CC=C1)C)CC(C=1C=CC=CC1)CCCCC |