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piperazine, 1-[[1-methyl-3-[[4-(phenylmethyl)-1-piperazinyl]carbonyl]-1H-pyrazol-5-yl]carbonyl]-4-(phenylmethyl)-
SpectraBase Compound ID 9qWBVNfIllp
InChI InChI=1S/C28H34N6O2/c1-30-26(28(36)34-18-14-32(15-19-34)22-24-10-6-3-7-11-24)20-25(29-30)27(35)33-16-12-31(13-17-33)21-23-8-4-2-5-9-23/h2-11,20H,12-19,21-22H2,1H3
InChIKey WMACPYHWRXYVLJ-UHFFFAOYSA-N
Mol Weight 486.6 g/mol
Molecular Formula C28H34N6O2
Exact Mass 486.274324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3UoF5uDQYkD
Name Piperazine, 1-[[1-methyl-3-[[4-(phenylmethyl)-1-piperazinyl]carbonyl]-1H-pyrazol-5-yl]carbonyl]-4-(phenylmethyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 486.274324357 u
Formula C28H34N6O2
InChI InChI=1S/C28H34N6O2/c1-30-26(28(36)34-18-14-32(15-19-34)22-24-10-6-3-7-11-24)20-25(29-30)27(35)33-16-12-31(13-17-33)21-23-8-4-2-5-9-23/h2-11,20H,12-19,21-22H2,1H3
InChIKey WMACPYHWRXYVLJ-UHFFFAOYSA-N
Molecular Weight 486.620 g/mol
SMILES C1(=CC(C(=O)N2CCN(CC3=CC=CC=C3)CC2)=NN1C)C(N1CCN(CC1)CC1=CC=CC=C1)=O