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2,5-Diethyl-3,4-diphenyl cyclopentadienone

View entire compound with spectra: 1 FTIR

2,5-Diethyl-3,4-diphenyl cyclopentadienone
SpectraBase Compound ID HKnxmZbDigB
InChI InChI=1S/C21H20O/c1-3-17-19(15-11-7-5-8-12-15)20(18(4-2)21(17)22)16-13-9-6-10-14-16/h5-14H,3-4H2,1-2H3
InChIKey MTZCOHPDBKHNON-UHFFFAOYSA-N
Mol Weight 288.39 g/mol
Molecular Formula C21H20O
Exact Mass 288.151415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID A7ChdAkmyOs
Name 2,5-Diethyl-3,4-diphenyl cyclopentadienone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 288.151415263 u
Formula C21H20O
InChI InChI=1S/C21H20O/c1-3-17-19(15-11-7-5-8-12-15)20(18(4-2)21(17)22)16-13-9-6-10-14-16/h5-14H,3-4H2,1-2H3
InChIKey MTZCOHPDBKHNON-UHFFFAOYSA-N
SMILES C1(=C(C(=O)C(=C1C1=CC=CC=C1)CC)CC)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.900695