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1,4-Dibromo-2,5-di-n-butylbenzene

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

1,4-Dibromo-2,5-di-n-butylbenzene
SpectraBase Compound ID FG0M0ABrAXY
InChI InChI=1S/C14H20Br2/c1-3-5-7-11-9-14(16)12(8-6-4-2)10-13(11)15/h9-10H,3-8H2,1-2H3
InChIKey KQPSJOQJXHBNRY-UHFFFAOYSA-N
Mol Weight 348.12 g/mol
Molecular Formula C14H20Br2
Exact Mass 345.993177 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Hx506T4i15v
Name 1,4-Dibromo-2,5-di-N-butylbenzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.993176644 u
Formula C14H20Br2
InChI InChI=1S/C14H20Br2/c1-3-5-7-11-9-14(16)12(8-6-4-2)10-13(11)15/h9-10H,3-8H2,1-2H3
InChIKey KQPSJOQJXHBNRY-UHFFFAOYSA-N
Molecular Weight 348.122 g/mol
SMILES C=1(C(=CC(=C(C1)CCCC)Br)CCCC)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865958