| SpectraBase Spectrum ID |
7I8CEOB9YSS |
| Name |
Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarbonitrile, 5,6-dimethyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
170.084398330 u |
| Formula |
C11H10N2 |
| InChI |
InChI=1S/C11H10N2/c1-6-7(2)9-3-8(6)10(4-12)11(9)5-13/h8-9H,3H2,1-2H3 |
| InChIKey |
ZPWHKGJEEHUNTE-UHFFFAOYSA-N |
| Molecular Weight |
170.215 g/mol |
| SMILES |
C1(=C(C2CC1C(=C2C)C)C#N)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.851191 |
![Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarbonitrile, 5,6-dimethyl-](/api/spectrum/7I8CEOB9YSS/structure.png?h=300&w=458 "Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarbonitrile, 5,6-dimethyl-")
