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3-Fluorobenzoic acid, N'-(1-ethyl-2,5-dioxopyrrolidin-3-yl)hydrazide

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-Fluorobenzoic acid, N'-(1-ethyl-2,5-dioxopyrrolidin-3-yl)hydrazide
SpectraBase Compound ID BDO2RqD30jq
InChI InChI=1S/C13H14FN3O3/c1-2-17-11(18)7-10(13(17)20)15-16-12(19)8-4-3-5-9(14)6-8/h3-6,10,15H,2,7H2,1H3,(H,16,19)
InChIKey VLBORCWONHZMKM-UHFFFAOYSA-N
Mol Weight 279.27 g/mol
Molecular Formula C13H14FN3O3
Exact Mass 279.101919 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DsmUErgYkAD
Name 3-Fluorobenzoic acid, N'-(1-ethyl-2,5-dioxopyrrolidin-3-yl)hydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.101919483 u
Formula C13H14FN3O3
InChI InChI=1S/C13H14FN3O3/c1-2-17-11(18)7-10(13(17)20)15-16-12(19)8-4-3-5-9(14)6-8/h3-6,10,15H,2,7H2,1H3,(H,16,19)
InChIKey VLBORCWONHZMKM-UHFFFAOYSA-N
Molecular Weight 279.271 g/mol
SMILES CCN1C(C(NNC(C=2C=C(C=CC2)F)=O)CC1=O)=O