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3,5-Bis(2'-nphthalenylmethyloxy)benzyl bromide

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

3,5-Bis(2'-nphthalenylmethyloxy)benzyl bromide
SpectraBase Compound ID JsVNT2ihrAf
InChI InChI=1S/C29H23BrO2/c30-18-23-15-28(31-19-21-9-11-24-5-1-3-7-26(24)13-21)17-29(16-23)32-20-22-10-12-25-6-2-4-8-27(25)14-22/h1-17H,18-20H2
InChIKey CUWVNVQLWPRINU-UHFFFAOYSA-N
Mol Weight 483.41 g/mol
Molecular Formula C29H23BrO2
Exact Mass 482.088143 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CNPi74SXMEc
Name 3,5-bis(2'-Nphthalenylmethyloxy)benzyl bromide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 482.088142979 u
Formula C29H23BrO2
InChI InChI=1S/C29H23BrO2/c30-18-23-15-28(31-19-21-9-11-24-5-1-3-7-26(24)13-21)17-29(16-23)32-20-22-10-12-25-6-2-4-8-27(25)14-22/h1-17H,18-20H2
InChIKey CUWVNVQLWPRINU-UHFFFAOYSA-N
Molecular Weight 483.405 g/mol
SMILES C12=CC(COC=3C=C(OCC4=CC5=CC=CC=C5C=C4)C=C(C3)CBr)=CC=C2C=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.945253