SpectraBase Spectrum ID |
Jnm5ehbTWR5 |
Name |
3-Pentenenitrile, 3-methyl-2-[(1-methylethyl)imino]-, (?,E)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
150.115698459 u |
Formula |
C9H14N2 |
InChI |
InChI=1S/C9H14N2/c1-5-8(4)9(6-10)11-7(2)3/h5,7H,1-4H3/b8-5+,11-9- |
InChIKey |
HHBLLUCBWUBALV-PAUBHIBZSA-N |
Molecular Weight |
150.225 g/mol |
SMILES |
C(\N=C\(C#N)\C(=C\C)C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953652 |