| SpectraBase Spectrum ID |
7VAqiuxdXqF |
| Name |
Terphenyl, 2,5,4''-trichloro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
331.992633454 u |
| Formula |
C18H11Cl3 |
| InChI |
InChI=1S/C18H11Cl3/c19-15-7-5-13(6-8-15)12-1-3-14(4-2-12)17-11-16(20)9-10-18(17)21/h1-11H |
| InChIKey |
PERMVKOWFVIOCX-UHFFFAOYSA-N |
| Molecular Weight |
333.645 g/mol |
| SMILES |
C1=C(C=CC(=C1C1=CC=C(C=C1)C1=CC=C(C=C1)Cl)Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910504 |
