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2-(1-Bromoethyl)-4,5-dimethoxycarbonyl-2-phenyl-1,3-dioxolane

View entire compound with spectra: 1 FTIR

2-(1-Bromoethyl)-4,5-dimethoxycarbonyl-2-phenyl-1,3-dioxolane
SpectraBase Compound ID FXfDwCrAx5I
InChI InChI=1S/C15H17BrO6/c1-9(16)15(10-7-5-4-6-8-10)21-11(13(17)19-2)12(22-15)14(18)20-3/h4-9,11-12H,1-3H3
InChIKey OWDIWDLQDRAVRZ-UHFFFAOYSA-N
Mol Weight 373.2 g/mol
Molecular Formula C15H17BrO6
Exact Mass 372.020851 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8D1Avhso5C6
Name 2-(1-Bromoethyl)-4,5-dimethoxycarbonyl-2-phenyl-1,3-dioxolane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.020851261 u
Formula C15H17BrO6
InChI InChI=1S/C15H17BrO6/c1-9(16)15(10-7-5-4-6-8-10)21-11(13(17)19-2)12(22-15)14(18)20-3/h4-9,11-12H,1-3H3
InChIKey OWDIWDLQDRAVRZ-UHFFFAOYSA-N
Molecular Weight 373.199 g/mol
SMILES C1(OC(C(OC)=O)C(O1)C(=O)OC)(C(Br)C)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.922842