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4,4-Dimethyl-5-(1-phenyl-1-propenyl)-1,3-dioxolan-2-one

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

4,4-Dimethyl-5-(1-phenyl-1-propenyl)-1,3-dioxolan-2-one
SpectraBase Compound ID sADRBK2Cny
InChI InChI=1S/C14H16O3/c1-4-11(10-8-6-5-7-9-10)12-14(2,3)17-13(15)16-12/h4-9,12H,1-3H3/b11-4+
InChIKey SJQLZPXYSPKWCK-NYYWCZLTSA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 85gHgWjpd5f
Name 4,4-Dimethyl-5-(1-phenyl-1-propenyl)-1,3-dioxolan-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 232.109944372 u
Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-4-11(10-8-6-5-7-9-10)12-14(2,3)17-13(15)16-12/h4-9,12H,1-3H3/b11-4+
InChIKey SJQLZPXYSPKWCK-NYYWCZLTSA-N
Molecular Weight 232.279 g/mol
SMILES C1(C(OC(O1)=O)(C)C)\C(C=1C=CC=CC1)=C\C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.87939