| SpectraBase Compound ID | DHw1MuMwxnX |
|---|---|
| InChI | InChI=1S/C14H13N/c1-11(8-9-15)13-7-6-12-4-2-3-5-14(12)10-13/h2-7,10-11H,8H2,1H3 |
| InChIKey | JQZGOPUXYXLLLJ-UHFFFAOYSA-N |
| Mol Weight | 195.26 g/mol |
| Molecular Formula | C14H13N |
| Exact Mass | 195.104799 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6lGra2V9UCP |
|---|---|
| Name | 3-(Naphthalen-2-yl)butanenitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 195.104799423 u |
| Formula | C14H13N |
| InChI | InChI=1S/C14H13N/c1-11(8-9-15)13-7-6-12-4-2-3-5-14(12)10-13/h2-7,10-11H,8H2,1H3 |
| InChIKey | JQZGOPUXYXLLLJ-UHFFFAOYSA-N |
| Molecular Weight | 195.265 g/mol |
| SMILES | C1=CC(=CC=2C1=CC=CC2)C(C)CC#N |