SpectraBase Spectrum ID |
GJAOUAi5JU8 |
Name |
9-Phenanthrenecarbonitrile, 9,10-dihydro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
205.089149358 u |
Formula |
C15H11N |
InChI |
InChI=1S/C15H11N/c16-10-12-9-11-5-1-2-6-13(11)15-8-4-3-7-14(12)15/h1-8,12H,9H2 |
InChIKey |
YAZIEMKGAIIMKF-UHFFFAOYSA-N |
Molecular Weight |
205.260 g/mol |
SMILES |
C(#N)C1C2=C(C=3C(C1)=CC=CC3)C=CC=C2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940832 |