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1,4-bis(4-Chloranylbutoxymethyl)benzene

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

1,4-bis(4-Chloranylbutoxymethyl)benzene
SpectraBase Compound ID Ap6udKxo602
InChI InChI=1S/C16H24Cl2O2/c17-9-1-3-11-19-13-15-5-7-16(8-6-15)14-20-12-4-2-10-18/h5-8H,1-4,9-14H2
InChIKey OEYOJTSZSLUQIT-UHFFFAOYSA-N
Mol Weight 319.27 g/mol
Molecular Formula C16H24Cl2O2
Exact Mass 318.115335 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DHk954AeGsu
Name 1,4-bis(4-Chloranylbutoxymethyl)benzene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.115335411 u
Formula C16H24Cl2O2
InChI InChI=1S/C16H24Cl2O2/c17-9-1-3-11-19-13-15-5-7-16(8-6-15)14-20-12-4-2-10-18/h5-8H,1-4,9-14H2
InChIKey OEYOJTSZSLUQIT-UHFFFAOYSA-N
Molecular Weight 319.272 g/mol
SMILES C=1(C=CC(=CC1)COCCCCCl)COCCCCCl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.886866