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1-Phenyl-5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazolo[4,3-e]pyrrolo[1,2-a]-pyrazine
SpectraBase Compound ID 3NidEKOgFFQ
InChI InChI=1S/C20H15ClN4/c21-15-10-8-14(9-11-15)19-18-7-4-12-24(18)20-17(23-19)13-22-25(20)16-5-2-1-3-6-16/h1-13,19,23H
InChIKey IAXSDBFHZZJVDT-UHFFFAOYSA-N
Mol Weight 346.82 g/mol
Molecular Formula C20H15ClN4
Exact Mass 346.098524 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2xEK2K1dXzJ
Name 1-Phenyl-5-(4-chlorophenyl)-4,5-dihydro-1H-pyrazolo[4,3-E]pyrrolo[1,2-A]-pyrazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 346.098524199 u
Formula C20H15ClN4
InChI InChI=1S/C20H15ClN4/c21-15-10-8-14(9-11-15)19-18-7-4-12-24(18)20-17(23-19)13-22-25(20)16-5-2-1-3-6-16/h1-13,19,23H
InChIKey IAXSDBFHZZJVDT-UHFFFAOYSA-N
Molecular Weight 346.821 g/mol
SMILES C12=C(NC(C=3N2C=CC3)C2=CC=C(C=C2)Cl)C=NN1C=1C=CC=CC1