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3-[2,5-Dimethyl-4-(3-oxidanylidene-3-phenyl-propyl)piperazin-1-yl]-1-phenyl-propan-1-one
SpectraBase Compound ID AWATTiWSqLm
InChI InChI=1S/C24H30N2O2/c1-19-17-26(16-14-24(28)22-11-7-4-8-12-22)20(2)18-25(19)15-13-23(27)21-9-5-3-6-10-21/h3-12,19-20H,13-18H2,1-2H3
InChIKey UMKXAEWXXYSYTG-UHFFFAOYSA-N
Mol Weight 378.52 g/mol
Molecular Formula C24H30N2O2
Exact Mass 378.230728 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9AUj0UOR9Az
Name 3-[2,5-Dimethyl-4-(3-oxidanylidene-3-phenyl-propyl)piperazin-1-yl]-1-phenyl-propan-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 378.230728212 u
Formula C24H30N2O2
InChI InChI=1S/C24H30N2O2/c1-19-17-26(16-14-24(28)22-11-7-4-8-12-22)20(2)18-25(19)15-13-23(27)21-9-5-3-6-10-21/h3-12,19-20H,13-18H2,1-2H3
InChIKey UMKXAEWXXYSYTG-UHFFFAOYSA-N
Molecular Weight 378.516 g/mol
SMILES C1N(C(CN(C1C)CCC(=O)C=1C=CC=CC1)C)CCC(=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.916613