SpectraBase Spectrum ID |
2HCIe1Hu6dR |
Name |
Ethyl (E)-2-(5-fluoro-2-oxoindolin-3-ylidene)acetate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.064471346 u |
Formula |
C12H10FNO3 |
InChI |
InChI=1S/C12H10FNO3/c1-2-17-11(15)6-9-8-5-7(13)3-4-10(8)14-12(9)16/h3-6H,2H2,1H3,(H,14,16)/b9-6+ |
InChIKey |
HBPQUOICXVDBBP-RMKNXTFCSA-N |
Molecular Weight |
235.214 g/mol |
SMILES |
C(\C=C\1C(NC2=C1C=C(C=C2)F)=O)(=O)OCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806668 |