| SpectraBase Compound ID | JfS11gk8oxE |
|---|---|
| InChI | InChI=1S/C19H23NO/c1-3-4-5-16-10-12-18(13-11-16)19(21)20-14-17-8-6-15(2)7-9-17/h6-13H,3-5,14H2,1-2H3,(H,20,21) |
| InChIKey | OILHHDGOLDOTHB-UHFFFAOYSA-N |
| Mol Weight | 281.4 g/mol |
| Molecular Formula | C19H23NO |
| Exact Mass | 281.177964 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4kbrptYUpNS |
|---|---|
| Name | 4-Methylbenzylamine 4-butylbenzoyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.177964364 u |
| Formula | C19H23NO |
| InChI | InChI=1S/C19H23NO/c1-3-4-5-16-10-12-18(13-11-16)19(21)20-14-17-8-6-15(2)7-9-17/h6-13H,3-5,14H2,1-2H3,(H,20,21) |
| InChIKey | OILHHDGOLDOTHB-UHFFFAOYSA-N |
| SMILES | C=1(C(NCC=2C=CC(=CC2)C)=O)C=CC(=CC1)CCCC |