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3,5-Dimethoxy-4-hydroxyphenylacetic acid

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3,5-Dimethoxy-4-hydroxyphenylacetic acid
SpectraBase Compound ID fOf9JeawCD
InChI InChI=1S/C10H12O5/c1-14-7-3-6(5-9(11)12)4-8(15-2)10(7)13/h3-4,13H,5H2,1-2H3,(H,11,12)
InChIKey BQBQKSSTFGCRQL-UHFFFAOYSA-N
Mol Weight 212.2 g/mol
Molecular Formula C10H12O5
Exact Mass 212.068473 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 75WV02xIv7R
Name 3,5-Dimethoxy-4-hydroxyphenylacetic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.068473481 u
Formula C10H12O5
InChI InChI=1S/C10H12O5/c1-14-7-3-6(5-9(11)12)4-8(15-2)10(7)13/h3-4,13H,5H2,1-2H3,(H,11,12)
InChIKey BQBQKSSTFGCRQL-UHFFFAOYSA-N
Molecular Weight 212.201 g/mol
SMILES C1=C(C=C(C(=C1OC)O)OC)CC(O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.899874