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Methyl ester of tris[(dimethylisopropyl)oxy]-N-propylamido-11-dehydrothromboxane - B3 - derivative
SpectraBase Compound ID 5kGFm2W77Xp
InChI InChI=1S/C39H77NO6Si3/c1-16-18-21-24-34(44-47(10,11)31(3)4)27-28-36(45-48(12,13)32(5)6)35(25-22-19-20-23-26-39(42)43-9)37(30-38(41)40-29-17-2)46-49(14,15)33(7)8/h18-19,21-22,27-28,31-37H,16-17,20,23-26,29-30H2,1-15H3,(H,40,41)/b21-18-,22-19-,28-27+/t34?,35-,36?,37?/m1/s1
InChIKey PFNPGPIRNKEMMK-ZTVBHKKISA-N
Mol Weight 740.3 g/mol
Molecular Formula C39H77NO6Si3
Exact Mass 739.505869 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 24MyeGjcvVS
Name Methyl ester of tris[(dimethylisopropyl)oxy]-N-propylamido-11-dehydrothromboxane - B3 - derivative
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Formula C39H77NO6Si3
InChI InChI=1S/C39H77NO6Si3/c1-16-18-21-24-34(44-47(10,11)31(3)4)27-28-36(45-48(12,13)32(5)6)35(25-22-19-20-23-26-39(42)43-9)37(30-38(41)40-29-17-2)46-49(14,15)33(7)8/h18-19,21-22,27-28,31-37H,16-17,20,23-26,29-30H2,1-15H3,(H,40,41)/b21-18-,22-19-,28-27+/t34?,35-,36?,37?/m1/s1
InChIKey PFNPGPIRNKEMMK-ZTVBHKKISA-N
Molecular Weight 740.301 g/mol
SMILES N(C(CC(O[Si](C(C)C)(C)C)[C@@](C(O[Si](C(C)C)(C)C)\C=C\C(O[Si](C(C)C)(C)C)C\C=C/CC)(C\C=C/CCCC(=O)OC)[H])=O)CCC
SPLASH splash10-0f6t-0530349100-38d1246f3ddb6f4a4a83
Source of Spectrum O-0-8119-0
Wiley ID 762957