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Pentane-1,5-diamide, N,N'-bis(2-nitrophenyl)-

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Pentane-1,5-diamide, N,N'-bis(2-nitrophenyl)-
SpectraBase Compound ID JtQtsnLGYbE
InChI InChI=1S/C17H16N4O6/c22-16(18-12-6-1-3-8-14(12)20(24)25)10-5-11-17(23)19-13-7-2-4-9-15(13)21(26)27/h1-4,6-9H,5,10-11H2,(H,18,22)(H,19,23)
InChIKey MLJHGYXMONRXEY-UHFFFAOYSA-N
Mol Weight 372.34 g/mol
Molecular Formula C17H16N4O6
Exact Mass 372.106984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5ll9UZwmRdN
Name Pentane-1,5-diamide, N,N'-bis(2-nitrophenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.106984245 u
Formula C17H16N4O6
InChI InChI=1S/C17H16N4O6/c22-16(18-12-6-1-3-8-14(12)20(24)25)10-5-11-17(23)19-13-7-2-4-9-15(13)21(26)27/h1-4,6-9H,5,10-11H2,(H,18,22)(H,19,23)
InChIKey MLJHGYXMONRXEY-UHFFFAOYSA-N
Molecular Weight 372.337 g/mol
SMILES C1=CC=C(N(=O)=O)C(=C1)NC(=O)CCCC(NC=1C(N(=O)=O)=CC=CC1)=O