| SpectraBase Compound ID | EyuKwhQ7no4 |
|---|---|
| InChI | InChI=1S/C15H21N3/c1-13-5-4-6-14(11-13)17-7-9-18(10-8-17)15(2,3)12-16/h4-6,11H,7-10H2,1-3H3 |
| InChIKey | NQZPVHYANVSUSG-UHFFFAOYSA-N |
| Mol Weight | 243.35 g/mol |
| Molecular Formula | C15H21N3 |
| Exact Mass | 243.173548 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DynHbvBBYhz |
|---|---|
| Name | alpha,alpha-Dimethyl-4-m-tolyl-1-piperazineacetonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.173547688 u |
| Formula | C15H21N3 |
| InChI | InChI=1S/C15H21N3/c1-13-5-4-6-14(11-13)17-7-9-18(10-8-17)15(2,3)12-16/h4-6,11H,7-10H2,1-3H3 |
| InChIKey | NQZPVHYANVSUSG-UHFFFAOYSA-N |
| Molecular Weight | 243.354 g/mol |
| SMILES | CC1=CC=CC(N2CCN(C(C#N)(C)C)CC2)=C1 |