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3,6-Dibenzylidene-2,5-piperazinedione

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

3,6-Dibenzylidene-2,5-piperazinedione
SpectraBase Compound ID APjGjRjbCrd
InChI InChI=1S/C18H14N2O2/c21-17-15(11-13-7-3-1-4-8-13)19-18(22)16(20-17)12-14-9-5-2-6-10-14/h1-12H,(H,19,22)(H,20,21)
InChIKey RFSUEJIDSYCCLL-UHFFFAOYSA-N
Mol Weight 290.32 g/mol
Molecular Formula C18H14N2O2
Exact Mass 290.105528 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 76jQq7mYLs1
Name 3,6-Dibenzylidene-2,5-piperazinedione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.105527697 u
Formula C18H14N2O2
InChI InChI=1S/C18H14N2O2/c21-17-15(11-13-7-3-1-4-8-13)19-18(22)16(20-17)12-14-9-5-2-6-10-14/h1-12H,(H,19,22)(H,20,21)
InChIKey RFSUEJIDSYCCLL-UHFFFAOYSA-N
Molecular Weight 290.322 g/mol
SMILES N1C(C(NC(C1=O)=CC=1C=CC=CC1)=O)=CC1=CC=CC=C1
Spectrum/Structure Validation Score (Raman) 0.911827