| SpectraBase Spectrum ID |
Ucw7zciL7M |
| Name |
Glutaric acid, 2-(4-bromophenoxy)ethyl ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
358.041586707 u |
| Formula |
C15H19BrO5 |
| InChI |
InChI=1S/C15H19BrO5/c1-2-19-14(17)4-3-5-15(18)21-11-10-20-13-8-6-12(16)7-9-13/h6-9H,2-5,10-11H2,1H3 |
| InChIKey |
FXENXTKQWGHSGY-UHFFFAOYSA-N |
| Molecular Weight |
359.216 g/mol |
| SMILES |
C(OCCOC1=CC=C(C=C1)Br)(=O)CCCC(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.926088 |
