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(4-Chloro-2-methylphenoxy)acetic acid sodium salt

View entire compound with spectra: 1 FTIR, and 1 Raman

(4-Chloro-2-methylphenoxy)acetic acid sodium salt
SpectraBase Compound ID IeOcq4cP3NX
InChI InChI=1S/C9H9ClO3.Na/c1-6-4-7(10)2-3-8(6)13-5-9(11)12;/h2-4H,5H2,1H3,(H,11,12);/q;+1/p-1
InChIKey STAPBGVGYWCRTF-UHFFFAOYSA-M
Mol Weight 222.6 g/mol
Molecular Formula C9H8ClNaO3
Exact Mass 222.005966 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 3KFeQNUSoAS
Name (4-Chloro-2-methylphenoxy)acetic acid sodium salt
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.005966095 u
Formula C9H8ClNaO3
InChI InChI=1S/C9H9ClO3.Na/c1-6-4-7(10)2-3-8(6)13-5-9(11)12;/h2-4H,5H2,1H3,(H,11,12);/q;+1/p-1
InChIKey STAPBGVGYWCRTF-UHFFFAOYSA-M
Molecular Weight 222.603 g/mol
SMILES [Na+].C([O-])(=O)COC1=C(C=C(C=C1)Cl)C
Spectrum/Structure Validation Score (Raman) 0.901529