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N,N'-bis(p-Fluorophenylidene)-mono-(1-methylpropyl)-malonyl-hydrazide

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N,N'-bis(p-Fluorophenylidene)-mono-(1-methylpropyl)-malonyl-hydrazide
SpectraBase Compound ID KLfUFtfIITq
InChI InChI=1S/C21H22F2N4O2/c1-3-14(2)19(20(28)26-24-12-15-4-8-17(22)9-5-15)21(29)27-25-13-16-6-10-18(23)11-7-16/h4-14,19H,3H2,1-2H3,(H,26,28)(H,27,29)/b24-12-,25-13+
InChIKey NZCFZCJPIIKDGH-UNFIKANMSA-N
Mol Weight 400.43 g/mol
Molecular Formula C21H22F2N4O2
Exact Mass 400.171082 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BdqNz37WaF6
Name N,N'-bis(p-Fluorophenylidene)-mono-(1-methylpropyl)-malonyl-hydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.171082288 u
Formula C21H22F2N4O2
InChI InChI=1S/C21H22F2N4O2/c1-3-14(2)19(20(28)26-24-12-15-4-8-17(22)9-5-15)21(29)27-25-13-16-6-10-18(23)11-7-16/h4-14,19H,3H2,1-2H3,(H,26,28)(H,27,29)/b24-12-,25-13+
InChIKey NZCFZCJPIIKDGH-UNFIKANMSA-N
Molecular Weight 400.430 g/mol
SMILES C(C(N\N=C/C1=CC=C(C=C1)F)=O)(C(N\N=C\C1=CC=C(C=C1)F)=O)C(CC)C