| SpectraBase Spectrum ID |
9nifzodBdAs |
| Name |
1,1,1-Trichloro-4,4-diphenylbut-3-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.008283519 u |
| Formula |
C16H13Cl3 |
| InChI |
InChI=1S/C16H13Cl3/c17-16(18,19)12-11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-11H,12H2 |
| InChIKey |
RKNQBZRCTRRCLK-UHFFFAOYSA-N |
| Molecular Weight |
311.639 g/mol |
| SMILES |
C(CC=C(C=1C=CC=CC1)C=1C=CC=CC1)(Cl)(Cl)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887187 |
