| SpectraBase Spectrum ID |
IN3GjEfyWsI |
| Name |
2-(4-Bromophenoxy)ethanol, tert.-butyl ether |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.041192785 u |
| Formula |
C12H17BrO2 |
| InChI |
InChI=1S/C12H17BrO2/c1-12(2,3)15-9-8-14-11-6-4-10(13)5-7-11/h4-7H,8-9H2,1-3H3 |
| InChIKey |
JGEFIHCLSVJLQT-UHFFFAOYSA-N |
| Molecular Weight |
273.170 g/mol |
| SMILES |
C1=C(C=CC(=C1)Br)OCCOC(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942531 |
