| SpectraBase Compound ID | DlAw5QrZhDX |
|---|---|
| InChI | InChI=1S/C19H21N3/c1-21(15-20)13-6-14-22-18-9-4-2-7-16(18)11-12-17-8-3-5-10-19(17)22/h2-5,7-10H,6,11-14H2,1H3 |
| InChIKey | FVZOHQPOJHBFDR-UHFFFAOYSA-N |
| Mol Weight | 291.4 g/mol |
| Molecular Formula | C19H21N3 |
| Exact Mass | 291.173548 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4yF2CFj4EPb |
|---|---|
| Name | N-Cyanoimipramine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 291.173547688 u |
| Formula | C19H21N3 |
| InChI | InChI=1S/C19H21N3/c1-21(15-20)13-6-14-22-18-9-4-2-7-16(18)11-12-17-8-3-5-10-19(17)22/h2-5,7-10H,6,11-14H2,1H3 |
| InChIKey | FVZOHQPOJHBFDR-UHFFFAOYSA-N |
| Molecular Weight | 291.398 g/mol |
| SMILES | C1=2N(C3=C(CCC2C=CC=C1)C=CC=C3)CCCN(C#N)C |