SpectraBase Spectrum ID |
46b9RDRpRd8 |
Name |
[1,1':4',1''-Terphenyl]-4-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
245.120449487 u |
Formula |
C18H15N |
InChI |
InChI=1S/C18H15N/c19-18-12-10-17(11-13-18)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-13H,19H2 |
InChIKey |
ATGIXVUZFPZOHP-UHFFFAOYSA-N |
Molecular Weight |
245.325 g/mol |
SMILES |
C1(N)=CC=C(C=C1)C1=CC=C(C=C1)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.829102 |