| SpectraBase Spectrum ID |
98T5sRdLkqz |
| Name |
2,5-Dichlorobenzyl alcohol, tert.-butyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
232.042170470 u |
| Formula |
C11H14Cl2O |
| InChI |
InChI=1S/C11H14Cl2O/c1-11(2,3)14-7-8-6-9(12)4-5-10(8)13/h4-6H,7H2,1-3H3 |
| InChIKey |
HHRQHIPLNPOIOL-UHFFFAOYSA-N |
| Molecular Weight |
233.138 g/mol |
| SMILES |
C1(=C(C=CC(=C1)Cl)Cl)COC(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90101 |
