| SpectraBase Spectrum ID |
5InoLpjxqf5 |
| Name |
2H-Cyclohepta[B]furan-3,3(4H)-dicarbonitrile, 5,6,7,8-tetrahydro-2-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.126263142 u |
| Formula |
C17H16N2O |
| InChI |
InChI=1S/C17H16N2O/c18-11-17(12-19)14-9-5-2-6-10-15(14)20-16(17)13-7-3-1-4-8-13/h1,3-4,7-8,16H,2,5-6,9-10H2 |
| InChIKey |
JCCPXTKEPREXQF-UHFFFAOYSA-N |
| Molecular Weight |
264.328 g/mol |
| SMILES |
C1(C2=C(CCCCC2)OC1C=1C=CC=CC1)(C#N)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901313 |
![2H-Cyclohepta[b]furan-3,3(4H)-dicarbonitrile, 5,6,7,8-tetrahydro-2-phenyl-](/api/spectrum/5InoLpjxqf5/structure.png?h=300&w=458 "2H-Cyclohepta[b]furan-3,3(4H)-dicarbonitrile, 5,6,7,8-tetrahydro-2-phenyl-")
