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2-Bromo-4,5-dimethoxybenzoic acid
SpectraBase Compound ID L0GrKU3zpKM
InChI InChI=1S/C9H9BrO4/c1-13-7-3-5(9(11)12)6(10)4-8(7)14-2/h3-4H,1-2H3,(H,11,12)
InChIKey HWFCHCRFQWEFMU-UHFFFAOYSA-N
Mol Weight 261.07 g/mol
Molecular Formula C9H9BrO4
Exact Mass 259.968422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Zj5mGYGjXk
Name 2-Bromo-4,5-dimethoxybenzoic acid
CAS Registry Number 6286-46-0
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 259.968421766 u
Formula C9H9BrO4
InChI InChI=1S/C9H9BrO4/c1-13-7-3-5(9(11)12)6(10)4-8(7)14-2/h3-4H,1-2H3,(H,11,12)
InChIKey HWFCHCRFQWEFMU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 261.071 g/mol
Nominal Mass 260 u
Quality 985
Retention Index 1898
SMILES OC(C=1C(=CC(=C(C1)OC)OC)Br)=O
SPLASH splash10-03di-3490000000-a99cdba6fdbde298dfe1
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_024330