| SpectraBase Compound ID | 7bm9F1Eokqu |
|---|---|
| InChI | InChI=1S/C16H13N/c17-12-15-11-16(15,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11H2 |
| InChIKey | DHLFXGMJDRNWME-UHFFFAOYSA-N |
| Mol Weight | 219.29 g/mol |
| Molecular Formula | C16H13N |
| Exact Mass | 219.104799 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ATPI5uYl4J |
|---|---|
| Name | 2,2-Diphenyl-1-cyclopropanecarbonitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 219.104799423 u |
| Formula | C16H13N |
| InChI | InChI=1S/C16H13N/c17-12-15-11-16(15,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15H,11H2 |
| InChIKey | DHLFXGMJDRNWME-UHFFFAOYSA-N |
| Molecular Weight | 219.287 g/mol |
| SMILES | C1(C(C#N)C1)(C1=CC=CC=C1)C=1C=CC=CC1 |