| SpectraBase Spectrum ID |
BUNaYh5M4lD |
| Name |
4-Hydroxy-2',5'-dichlorobiphenyl, trimethylacetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.052735153 u |
| Formula |
C17H16Cl2O2 |
| InChI |
InChI=1S/C17H16Cl2O2/c1-17(2,3)16(20)21-13-7-4-11(5-8-13)14-10-12(18)6-9-15(14)19/h4-10H,1-3H3 |
| InChIKey |
SZXNETNMOQRWQN-UHFFFAOYSA-N |
| Molecular Weight |
323.219 g/mol |
| SMILES |
C1(C2=C(C=CC(=C2)Cl)Cl)=CC=C(C=C1)OC(C(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.814972 |
