SpectraBase Spectrum ID |
7xYoET9N4MU |
Name |
2,5-Dimethoxyphenol, hfb |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
350.038905907 u |
Formula |
C12H9F7O4 |
InChI |
InChI=1S/C12H9F7O4/c1-21-6-3-4-7(22-2)8(5-6)23-9(20)10(13,14)11(15,16)12(17,18)19/h3-5H,1-2H3 |
InChIKey |
RBWJBCMATQGXGQ-UHFFFAOYSA-N |
Molecular Weight |
350.189 g/mol |
SMILES |
COC1=CC(OC(C(F)(F)C(F)(F)C(F)(F)F)=O)=C(C=C1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933791 |