| SpectraBase Compound ID | 1zNUocEp4EX |
|---|---|
| InChI | InChI=1S/C9H10N2/c1-7(11)9-4-2-8(6-10)3-5-9/h2-5,7H,11H2,1H3 |
| InChIKey | CANLULJYEHSQFU-UHFFFAOYSA-N |
| Mol Weight | 146.19 g/mol |
| Molecular Formula | C9H10N2 |
| Exact Mass | 146.084398 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 71Fjv2A7Xed |
|---|---|
| Name | 4-(1-Aminoethyl)benzonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 146.084398330 u |
| Formula | C9H10N2 |
| InChI | InChI=1S/C9H10N2/c1-7(11)9-4-2-8(6-10)3-5-9/h2-5,7H,11H2,1H3 |
| InChIKey | CANLULJYEHSQFU-UHFFFAOYSA-N |
| Molecular Weight | 146.193 g/mol |
| SMILES | NC(c1ccc(C#N)cc1)C |