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THIOBINUPHARIDINE, IODOMETHYLATE (ISOMER 3)
SpectraBase Compound ID FSXU5RG14N3
InChI InChI=1S/C31H45N2O2S.HI/c1-22-4-6-27(24-10-14-34-16-24)32-19-30(12-8-26(22)32)18-31(36-21-30)13-9-28-23(2)5-7-29(33(28,3)20-31)25-11-15-35-17-25;/h10-11,14-17,22-23,26-29H,4-9,12-13,18-21H2,1-3H3;1H/q+1;/p-1/t22-,23-,26+,27+,28+,29+,30?,31+,33+;/m0./s1
InChIKey DUAOEFLCZDCWIN-BBMUICSLSA-M
Mol Weight 636.7 g/mol
Molecular Formula C31H45IN2O2S
Exact Mass 636.224645 g/mol
Parent InChIKey RBWSNJAQHJJZAS-QAQZNMHPSA-M
Enantiomer InChIKey DUAOEFLCZDCWIN-NWCOFNGLSA-M
Unknown Identification

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