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2,4,6-Triphenyl-4H-pyran-3,5-dicarboxylicaldehyde

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2,4,6-Triphenyl-4H-pyran-3,5-dicarboxylicaldehyde
SpectraBase Compound ID 7IoDbFAa4LY
InChI InChI=1S/C25H18O3/c26-16-21-23(18-10-4-1-5-11-18)22(17-27)25(20-14-8-3-9-15-20)28-24(21)19-12-6-2-7-13-19/h1-17,23H
InChIKey ZBQLMKZWZMHJOO-UHFFFAOYSA-N
Mol Weight 366.42 g/mol
Molecular Formula C25H18O3
Exact Mass 366.125594 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JzMmXlLUah
Name 2,4,6-Triphenyl-4H-pyran-3,5-dicarboxylicaldehyde
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 366.125594437 u
Formula C25H18O3
InChI InChI=1S/C25H18O3/c26-16-21-23(18-10-4-1-5-11-18)22(17-27)25(20-14-8-3-9-15-20)28-24(21)19-12-6-2-7-13-19/h1-17,23H
InChIKey ZBQLMKZWZMHJOO-UHFFFAOYSA-N
Molecular Weight 366.416 g/mol
SMILES C1(=C(OC(=C(C1C1=CC=CC=C1)C=O)C=1C=CC=CC1)C=1C=CC=CC1)C=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941269