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3-[(4-chloroanilino)methyl]-1-[2-(4-chlorophenyl)-2-oxoethyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,5-a]azepin-1-ium bromide
SpectraBase Compound ID Gr0jPVmd8Hb
InChI InChI=1S/C22H23Cl2N4O.BrH/c23-17-7-5-16(6-8-17)20(29)15-28-22-4-2-1-3-13-27(22)21(26-28)14-25-19-11-9-18(24)10-12-19;/h5-12,25H,1-4,13-15H2;1H/q+1;/p-1
InChIKey SHQIDGRNOSPLQF-UHFFFAOYSA-M
Mol Weight 510.26 g/mol
Molecular Formula C22H23BrCl2N4O
Exact Mass 508.04323 g/mol
Parent InChIKey LQQOBBBJCBSRCF-UHFFFAOYSA-M
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