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Pentachloroanisole

View entire compound with spectra: 5 NMR, 1 FTIR, and 25 MS (GC)

Pentachloroanisole
SpectraBase Compound ID 7wfdiilPucF
InChI InChI=1S/C7H3Cl5O/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3
InChIKey BBABSCYTNHOKOG-UHFFFAOYSA-N
Mol Weight 280.4 g/mol
Molecular Formula C7H3Cl5O
Exact Mass 277.862653 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1VR2f8393n7
Name 2,3,4,5,6-Pentachloroanisole
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 362859
CAS Registry Number 1825-21-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H3Cl5O
InChI InChI=1S/C7H3Cl5O/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3
InChIKey BBABSCYTNHOKOG-UHFFFAOYSA-N
Observed nucleus 13C
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1,2,3,4,5-pentachloro-6-methoxybenzene Pentachloromethoxybenzene
Wiley ID SIAL_13CNMR_007583