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CRYPTOPORIC-ACID-G-TRI-PARA-BROMOPHENACYLESTER;CA-F-TRI-PARA-BROMOPHENACYLESTER
SpectraBase Compound ID 97n136YK5GA
InChI InChI=1S/C68H81Br3O18/c1-40-11-25-55-65(3,38-72)27-9-29-67(55,5)50(40)33-87-60(64(81)83-8)49(32-58(77)85-36-53(74)43-15-21-46(70)22-16-43)62(79)89-39-66(4)28-10-30-68(6)51(41(2)12-26-56(66)68)34-86-59(63(80)82-7)48(61(78)88-37-54(75)44-17-23-47(71)24-18-44)31-57(76)84-35-52(73)42-13-19-45(69)20-14-42/h13-24,48-51,55-56,59-60,72H,1-2,9-12,25-39H2,3-8H3/t48-,49+,50-,51+,55?,56?,59+,60-,65-,66+,67+,68-/m0/s1
InChIKey IKTVPVWLXIBCSF-OMHPJNDCSA-N
Mol Weight 1426.1 g/mol
Molecular Formula C68H81Br3O18
Exact Mass 1422.297305 g/mol
Enantiomer InChIKey IKTVPVWLXIBCSF-IFQYSZHFSA-N
Unknown Identification

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