SpectraBase Spectrum ID |
Kl8i5c5C43C |
Name |
alpha-Fluoro-3,4-(methylenedioxy)hydrocinnamamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
211.064471346 u |
Formula |
C10H10FNO3 |
InChI |
InChI=1S/C10H10FNO3/c11-7(10(12)13)3-6-1-2-8-9(4-6)15-5-14-8/h1-2,4,7H,3,5H2,(H2,12,13) |
InChIKey |
SUXIXKQDPLSAIE-UHFFFAOYSA-N |
Molecular Weight |
211.192 g/mol |
SMILES |
NC(C(CC1=CC2=C(C=C1)OCO2)F)=O |
Spectrum/Structure Validation Score (Raman) |
0.960168 |