SpectraBase Spectrum ID |
5LxdnHKEdq1 |
Name |
2-(T-Butylmethylamino)-2-cyclohexylidenethenenitrile |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
206.178298716 u |
Formula |
C13H22N2 |
InChI |
InChI=1S/C13H22N2/c1-13(2,3)15(4)12(10-14)11-8-6-5-7-9-11/h5-9H2,1-4H3 |
InChIKey |
CPTCLQKDMYLSLC-UHFFFAOYSA-N |
Molecular Weight |
206.333 g/mol |
SMILES |
C(N(C(C)(C)C)C)(C#N)=C1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.892746 |