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1-(6-oxo-6-{4-[(2E)-3-phenyl-2-propenyl]-1-piperazinyl}hexanoyl)-4-[(2E)-3-phenyl-2-propenyl]piperazine
SpectraBase Compound ID 3M3dpASaakN
InChI InChI=1S/C32H42N4O2/c37-31(35-25-21-33(22-26-35)19-9-15-29-11-3-1-4-12-29)17-7-8-18-32(38)36-27-23-34(24-28-36)20-10-16-30-13-5-2-6-14-30/h1-6,9-16H,7-8,17-28H2/b15-9+,16-10+
InChIKey ZHJUYVRFDZTBKU-KAVGSWPWSA-N
Mol Weight 514.7 g/mol
Molecular Formula C32H42N4O2
Exact Mass 514.330777 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5q61vpc75e4
Name 1-(6-oxo-6-{4-[(2E)-3-Phenyl-2-propenyl]-1-piperazinyl}hexanoyl)-4-[(2E)-3-phenyl-2-propenyl]piperazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 514.330776606 u
Formula C32H42N4O2
InChI InChI=1S/C32H42N4O2/c37-31(35-25-21-33(22-26-35)19-9-15-29-11-3-1-4-12-29)17-7-8-18-32(38)36-27-23-34(24-28-36)20-10-16-30-13-5-2-6-14-30/h1-6,9-16H,7-8,17-28H2/b15-9+,16-10+
InChIKey ZHJUYVRFDZTBKU-KAVGSWPWSA-N
Molecular Weight 514.714 g/mol
SMILES C1=CC=C(\C=C\CN2CCN(C(CCCCC(N3CCN(CC3)C\C=C\C3=CC=CC=C3)=O)=O)CC2)C=C1