| SpectraBase Spectrum ID |
IrlLWuSynfV |
| Name |
(E)-5-(3,3-Difluoroprop-1-enyl)benzo[D][1,3]dioxole |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
198.049235822 u |
| Formula |
C10H8F2O2 |
| InChI |
InChI=1S/C10H8F2O2/c11-10(12)4-2-7-1-3-8-9(5-7)14-6-13-8/h1-5,10H,6H2/b4-2+ |
| InChIKey |
HOOLYOMSQYNCIP-DUXPYHPUSA-N |
| Molecular Weight |
198.169 g/mol |
| SMILES |
C1=CC(=CC2=C1OCO2)\C=C\C(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937329 |
![(E)-5-(3,3-difluoroprop-1-enyl)benzo[d][1,3]dioxole](/api/spectrum/IrlLWuSynfV/structure.png?h=300&w=458 "(E)-5-(3,3-difluoroprop-1-enyl)benzo[d][1,3]dioxole")
