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1,5-Bis(naphthalen-1-yl)pentane-1,5-dione

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

1,5-Bis(naphthalen-1-yl)pentane-1,5-dione
SpectraBase Compound ID 1q0Xpw2bSK0
InChI InChI=1S/C25H20O2/c26-24(22-14-5-10-18-8-1-3-12-20(18)22)16-7-17-25(27)23-15-6-11-19-9-2-4-13-21(19)23/h1-6,8-15H,7,16-17H2
InChIKey RCGAUCWKCGDFEX-UHFFFAOYSA-N
Mol Weight 352.43 g/mol
Molecular Formula C25H20O2
Exact Mass 352.14633 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 23FMjaMBmDG
Name 1,5-bis(Naphthalen-1-yl)pentane-1,5-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.146329882 u
Formula C25H20O2
InChI InChI=1S/C25H20O2/c26-24(22-14-5-10-18-8-1-3-12-20(18)22)16-7-17-25(27)23-15-6-11-19-9-2-4-13-21(19)23/h1-6,8-15H,7,16-17H2
InChIKey RCGAUCWKCGDFEX-UHFFFAOYSA-N
Molecular Weight 352.433 g/mol
SMILES C1=CC(C(CCCC(C2=CC=CC3=CC=CC=C23)=O)=O)=C2C(=C1)C=CC=C2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.864609