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4,4-Dibutyl-3-methylene-5-phenyl-2-oxolanone

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

4,4-Dibutyl-3-methylene-5-phenyl-2-oxolanone
SpectraBase Compound ID DvkoDMRO3SO
InChI InChI=1S/C19H26O2/c1-4-6-13-19(14-7-5-2)15(3)18(20)21-17(19)16-11-9-8-10-12-16/h8-12,17H,3-7,13-14H2,1-2H3
InChIKey RBDFFLMCVCSHQA-UHFFFAOYSA-N
Mol Weight 286.41 g/mol
Molecular Formula C19H26O2
Exact Mass 286.19328 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Fg3C6cmuVPz
Name 4,4-Dibutyl-3-methylene-5-phenyl-2-oxolanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 286.193280075 u
Formula C19H26O2
InChI InChI=1S/C19H26O2/c1-4-6-13-19(14-7-5-2)15(3)18(20)21-17(19)16-11-9-8-10-12-16/h8-12,17H,3-7,13-14H2,1-2H3
InChIKey RBDFFLMCVCSHQA-UHFFFAOYSA-N
Molecular Weight 286.415 g/mol
SMILES C1(OC(C2=CC=CC=C2)C(C1=C)(CCCC)CCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.867371