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2,2-bis[4-(Allyloxy)-3,5-dibromophenyl]propane

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 Raman

2,2-bis[4-(Allyloxy)-3,5-dibromophenyl]propane
SpectraBase Compound ID 9XXlAhGSmbW
InChI InChI=1S/C21H20Br4O2/c1-5-7-26-19-15(22)9-13(10-16(19)23)21(3,4)14-11-17(24)20(18(25)12-14)27-8-6-2/h5-6,9-12H,1-2,7-8H2,3-4H3
InChIKey PWXTUWQHMIFLKL-UHFFFAOYSA-N
Mol Weight 624.0 g/mol
Molecular Formula C21H20Br4O2
Exact Mass 619.819682 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 9AoPk9YIsRx
Name 2,2-bis[4-(Allyloxy)-3,5-dibromophenyl]propane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 619.819681882 u
Formula C21H20Br4O2
InChI InChI=1S/C21H20Br4O2/c1-5-7-26-19-15(22)9-13(10-16(19)23)21(3,4)14-11-17(24)20(18(25)12-14)27-8-6-2/h5-6,9-12H,1-2,7-8H2,3-4H3
InChIKey PWXTUWQHMIFLKL-UHFFFAOYSA-N
Molecular Weight 624.005 g/mol
SMILES C=1C(=CC(=C(C1Br)OCC=C)Br)C(C=1C=C(C(=C(C1)Br)OCC=C)Br)(C)C
Spectrum/Structure Validation Score (Raman) 0.938725