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BIS-(2-NITRO-1,4-PHENYLENE)-MACROCYCLE
SpectraBase Compound ID 7w5xWASMg39
InChI InChI=1S/C72H102N2O22/c1-61(2,3)53-49-57(75)87-37-25-33-83-43-29-31-48(45(41-43)73(79)80)86-36-28-40-90-60(78)52-56(64(10,11)12)94-70(66(16,17)18)50(54(62(4,5)6)92-72(52,96-70)68(22,23)24)58(76)88-38-26-34-84-44-30-32-47(46(42-44)74(81)82)85-35-27-39-89-59(77)51-55(63(7,8)9)93-69(49,65(13,14)15)95-71(51,91-53)67(19,20)21/h29-32,41-42H,25-28,33-40H2,1-24H3/t69-,70+,71-,72+
InChIKey NDAUXLQKCQGMER-UNIDEBNKSA-N
Mol Weight 1347.6 g/mol
Molecular Formula C72H102N2O22
Exact Mass 1346.692423 g/mol
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