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Methyl 3,5-dichloro-4-hydroxybenzoate hydrate

View entire compound with spectra: 2 NMR, and 1 FTIR

Methyl 3,5-dichloro-4-hydroxybenzoate hydrate
SpectraBase Compound ID moWd8sBqNg
InChI InChI=1S/C8H6Cl2O3.O/c1-13-8(12)4-2-5(9)7(11)6(10)3-4;/h2-3,11H,1H3;
InChIKey IGAMEAGOQKIMFX-UHFFFAOYSA-N
Mol Weight 237.038 g/mol
Molecular Formula C8H6Cl2O4
Exact Mass 235.964314 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID Lva8rSchP2m
Name Methyl 3,5-dichloro-4-hydroxybenzoate hydrate
Source of Sample Aldrich
Catalog Number 389099
CAS Registry Number 287399-19-3
Comments MW calculated on anhydrous base
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6Cl2O3*xH2O
InChI InChI=1S/C8H6Cl2O3.O/c1-13-8(12)4-2-5(9)7(11)6(10)3-4;/h2-3,11H,1H3;
InChIKey IGAMEAGOQKIMFX-UHFFFAOYSA-N
Purity 99%
Wiley ID SIAL_ATR-IR_018127