SpectraBase Spectrum ID |
H8j0W8FJtdE |
Name |
Fumaric acid, monoamide, N-(4-chlorophenyl)-, 3,5-difluorophenyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
337.031727209 u |
Formula |
C16H10ClF2NO3 |
InChI |
InChI=1S/C16H10ClF2NO3/c17-10-1-3-13(4-2-10)20-15(21)5-6-16(22)23-14-8-11(18)7-12(19)9-14/h1-9H,(H,20,21)/b6-5+ |
InChIKey |
HFAUZDHXXZHRQK-AATRIKPKSA-N |
Molecular Weight |
337.710 g/mol |
SMILES |
C(\C=C\C(=O)NC1=CC=C(C=C1)Cl)(=O)OC1=CC(=CC(=C1)F)F |