SpectraBase Spectrum ID |
Qqz0VPw5UM |
Name |
(E)-1-(3,3-Difluoroprop-1-enyl)-4-methoxybenzene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
184.069971267 u |
Formula |
C10H10F2O |
InChI |
InChI=1S/C10H10F2O/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7,10H,1H3/b7-4+ |
InChIKey |
NIZLGMIHMZUXON-QPJJXVBHSA-N |
Molecular Weight |
184.186 g/mol |
SMILES |
C1=C(OC)C=CC(\C=C\C(F)F)=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921753 |