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3,6-diphenylpyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione
SpectraBase Compound ID J0DvoPg2npx
InChI InChI=1S/C18H12N2O2/c21-17-13-14(16(20-17)12-9-5-2-6-10-12)18(22)19-15(13)11-7-3-1-4-8-11/h1-10H,(H,19,22)(H,20,21)
InChIKey UWHBZLMSPZBZHY-UHFFFAOYSA-N
Mol Weight 288.31 g/mol
Molecular Formula C18H12N2O2
Exact Mass 288.089878 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID IyMdMqdvsHo
Name 3,6-Diphenylpyrrolo[3,4-C]pyrrole-1,4(2H,5H)-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.089877632 u
Formula C18H12N2O2
InChI InChI=1S/C18H12N2O2/c21-17-13-14(16(20-17)12-9-5-2-6-10-12)18(22)19-15(13)11-7-3-1-4-8-11/h1-10H,(H,19,22)(H,20,21)
InChIKey UWHBZLMSPZBZHY-UHFFFAOYSA-N
Molecular Weight 288.306 g/mol
SMILES N1C(=C2C(NC(=C2C1=O)C=1C=CC=CC1)=O)C=1C=CC=CC1
Spectrum/Structure Validation Score (Raman) 0.944898