| SpectraBase Compound ID | F2z753ZmHZL |
|---|---|
| InChI | InChI=1S/C14H11N/c1-11-4-2-3-5-14(11)13-8-6-12(10-15)7-9-13/h2-9H,1H3 |
| InChIKey | NTJHRYFSZWZHPG-UHFFFAOYSA-N |
| Mol Weight | 193.25 g/mol |
| Molecular Formula | C14H11N |
| Exact Mass | 193.089149 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 54pEbNW1vyi |
|---|---|
| Name | 4-Cyano-2'-methylbiphenyl |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.089149358 u |
| Formula | C14H11N |
| InChI | InChI=1S/C14H11N/c1-11-4-2-3-5-14(11)13-8-6-12(10-15)7-9-13/h2-9H,1H3 |
| InChIKey | NTJHRYFSZWZHPG-UHFFFAOYSA-N |
| Molecular Weight | 193.249 g/mol |
| SMILES | C(#N)C1=CC=C(C=2C(C)=CC=CC2)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.930111 |