| SpectraBase Compound ID | ENDjWvwBw5h |
|---|---|
| InChI | InChI=1S/C17H20N2O/c1-17(2,3)14-9-5-6-10-15(14)19(4)16(20)13-8-7-11-18-12-13/h5-12H,1-4H3 |
| InChIKey | NAQQSLUSCLXMBP-UHFFFAOYSA-N |
| Mol Weight | 268.36 g/mol |
| Molecular Formula | C17H20N2O |
| Exact Mass | 268.157563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2JNwvFpBRXj |
|---|---|
| Name | N-(2-Tert-butylphenyl)nicotinamide, N-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.157563271 u |
| Formula | C17H20N2O |
| InChI | InChI=1S/C17H20N2O/c1-17(2,3)14-9-5-6-10-15(14)19(4)16(20)13-8-7-11-18-12-13/h5-12H,1-4H3 |
| InChIKey | NAQQSLUSCLXMBP-UHFFFAOYSA-N |
| Molecular Weight | 268.360 g/mol |
| SMILES | C1(N(C(=O)C2=CN=CC=C2)C)=C(C=CC=C1)C(C)(C)C |