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3-Pyridinecarboxylic acid, 6-[[2-bromo-4-(1-methylethyl)phenyl]amino]-
SpectraBase Compound ID A4Lr0qLmyOx
InChI InChI=1S/C15H15BrN2O2/c1-9(2)10-3-5-13(12(16)7-10)18-14-6-4-11(8-17-14)15(19)20/h3-9H,1-2H3,(H,17,18)(H,19,20)
InChIKey BMJFAIDMBWCHSH-UHFFFAOYSA-N
Mol Weight 335.2 g/mol
Molecular Formula C15H15BrN2O2
Exact Mass 334.031691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BxKuZYznDu
Name 3-Pyridinecarboxylic acid, 6-[[2-bromo-4-(1-methylethyl)phenyl]amino]-
CAS Registry Number 107962-06-1
Comments Less than 3 mono-isotopic peaks
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Formula C15H15BrN2O2
InChI InChI=1S/C15H15BrN2O2/c1-9(2)10-3-5-13(12(16)7-10)18-14-6-4-11(8-17-14)15(19)20/h3-9H,1-2H3,(H,17,18)(H,19,20)
InChIKey BMJFAIDMBWCHSH-UHFFFAOYSA-N
Molecular Weight 335.201 g/mol
SMILES OC(c1ccc(Nc2c(cc(cc2)C(C)C)Br)nc1)=O
SPLASH splash10-0a4i-0094000000-289142baa1f28e955633
Source of Spectrum J-52-2472-9
Synonyms 2-[[2-bromo-4-(1-methylethyl)phenyl]amino]pyridine-5-carboxylic 6-(2-bromo-4-isopropylanilino)nicotinic acid
Wiley ID 1330656