For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Fumaric acid, monoamide, N-(2-fluorophenyl)-, isopropyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Fumaric acid, monoamide, N-(2-fluorophenyl)-, isopropyl ester
SpectraBase Compound ID 70qgsrB35Zs
InChI InChI=1S/C13H14FNO3/c1-9(2)18-13(17)8-7-12(16)15-11-6-4-3-5-10(11)14/h3-9H,1-2H3,(H,15,16)/b8-7+
InChIKey OFWWGYQJWWNCEP-BQYQJAHWSA-N
Mol Weight 251.26 g/mol
Molecular Formula C13H14FNO3
Exact Mass 251.095771 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2K2bFId2QkZ
Name Fumaric acid, monoamide, N-(2-fluorophenyl)-, isopropyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.095771475 u
Formula C13H14FNO3
InChI InChI=1S/C13H14FNO3/c1-9(2)18-13(17)8-7-12(16)15-11-6-4-3-5-10(11)14/h3-9H,1-2H3,(H,15,16)/b8-7+
InChIKey OFWWGYQJWWNCEP-BQYQJAHWSA-N
Molecular Weight 251.257 g/mol
SMILES CC(OC(=O)\C=C\C(=O)NC1=CC=CC=C1F)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.880146