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2,7-Diisobutoxyfluorene-9-one

View entire compound with spectra: 1 FTIR

2,7-Diisobutoxyfluorene-9-one
SpectraBase Compound ID 6SHZaT61xyY
InChI InChI=1S/C21H24O3/c1-13(2)11-23-15-5-7-17-18-8-6-16(24-12-14(3)4)10-20(18)21(22)19(17)9-15/h5-10,13-14H,11-12H2,1-4H3
InChIKey KPBKCLKOYMVNRA-UHFFFAOYSA-N
Mol Weight 324.42 g/mol
Molecular Formula C21H24O3
Exact Mass 324.172545 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IWRNokpiMr2
Name 2,7-Diisobutoxyfluorene-9-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.172544630 u
Formula C21H24O3
InChI InChI=1S/C21H24O3/c1-13(2)11-23-15-5-7-17-18-8-6-16(24-12-14(3)4)10-20(18)21(22)19(17)9-15/h5-10,13-14H,11-12H2,1-4H3
InChIKey KPBKCLKOYMVNRA-UHFFFAOYSA-N
Molecular Weight 324.420 g/mol
SMILES C1=2C(C3=CC(OCC(C)C)=CC=C3C2C=CC(=C1)OCC(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.812175