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

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

4,4-Dimethyl-5-(1-phenylethenyl)-1,3-dioxolan-2-one
SpectraBase Compound ID 3Sq3U0FJGsp
InChI InChI=1S/C13H14O3/c1-9(10-7-5-4-6-8-10)11-13(2,3)16-12(14)15-11/h4-8,11H,1H2,2-3H3
InChIKey DOBYZZWSHMSSBG-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 20aShRzjHkp
Name 4,4-Dimethyl-5-(1-phenylethenyl)-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 218.094294308 u
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-9(10-7-5-4-6-8-10)11-13(2,3)16-12(14)15-11/h4-8,11H,1H2,2-3H3
InChIKey DOBYZZWSHMSSBG-UHFFFAOYSA-N
Molecular Weight 218.252 g/mol
SMILES C1(C(OC(O1)=O)(C)C)C(C=1C=CC=CC1)=C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.931856