| SpectraBase Compound ID | HG2KH97vT1A |
|---|---|
| InChI | InChI=1S/C19H23NO/c1-14-10-11-18(12-15(14)2)19(21)16(3)20(4)13-17-8-6-5-7-9-17/h5-12,16H,13H2,1-4H3 |
| InChIKey | DJTNQDFMFBTZLU-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 | 6ipYo82qgmQ |
|---|---|
| Name | N-Benzyl-3,4-dmmc |
| 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/c1-14-10-11-18(12-15(14)2)19(21)16(3)20(4)13-17-8-6-5-7-9-17/h5-12,16H,13H2,1-4H3 |
| InChIKey | DJTNQDFMFBTZLU-UHFFFAOYSA-N |
| SMILES | C1(C(C(N(CC=2C=CC=CC2)C)C)=O)=CC(=C(C=C1)C)C |