| SpectraBase Spectrum ID |
L65xplnFcLC |
| Name |
2,2-Diphenyl-1-cyclopropanecarbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| 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 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973477 |
