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5-(2-Bromophenoxymethyl)-4-pyridazinecarboxylic acid
SpectraBase Compound ID B7rYElCQKbk
InChI InChI=1S/C12H9BrN2O3/c13-10-3-1-2-4-11(10)18-7-8-5-14-15-6-9(8)12(16)17/h1-6H,7H2,(H,16,17)
InChIKey IFWABACSNRJDKE-UHFFFAOYSA-N
Mol Weight 309.12 g/mol
Molecular Formula C12H9BrN2O3
Exact Mass 307.979655 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D2N9bVQABD5
Name 5-(2-Bromophenoxymethyl)-4-pyridazinecarboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C12H9BrN2O3
InChI InChI=1S/C12H9BrN2O3/c13-10-3-1-2-4-11(10)18-7-8-5-14-15-6-9(8)12(16)17/h1-6H,7H2,(H,16,17)
InChIKey IFWABACSNRJDKE-UHFFFAOYSA-N
Molecular Weight 309.119 g/mol
SMILES OC(c1c(COc2c(Br)cccc2)cnnc1)=O
SPLASH splash10-0006-9000000000-30796530c234d1eec23f
Source of Spectrum H1-41-1469-1
Wiley ID 757339