SpectraBase Spectrum ID |
KRmWdVAja7v |
Name |
[1,1':4',1''-Terphenyl]-2,2''-diamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
260.131348523 u |
Formula |
C18H16N2 |
InChI |
InChI=1S/C18H16N2/c19-17-7-3-1-5-15(17)13-9-11-14(12-10-13)16-6-2-4-8-18(16)20/h1-12H,19-20H2 |
InChIKey |
ASTNLTYJBWLGMV-UHFFFAOYSA-N |
Molecular Weight |
260.340 g/mol |
SMILES |
C1(N)=CC=CC=C1C=1C=CC(=CC1)C=1C=CC=CC1N |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956893 |