SpectraBase Spectrum ID |
KJoREt2dLc6 |
Name |
4-(2,6-Difluorostyryl)coumarin |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
284.064885886 u |
Formula |
C17H10F2O2 |
InChI |
InChI=1S/C17H10F2O2/c18-14-5-3-6-15(19)13(14)9-8-11-10-17(20)21-16-7-2-1-4-12(11)16/h1-10H/b9-8+ |
InChIKey |
VOFHGAVLWMXHTC-CMDGGOBGSA-N |
Molecular Weight |
284.262 g/mol |
SMILES |
C1(=CC(=O)OC2=C1C=CC=C2)\C=C\C=1C(F)=CC=CC1F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94035 |