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DMIPS-ether derivative of 11-dtxb2-methyl ester-11-n-propylamide
SpectraBase Compound ID 4BTvLOcxDdt
InChI InChI=1S/C39H79NO6Si3/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/h19,22,27-28,31-37H,16-18,20-21,23-26,29-30H2,1-15H3,(H,40,41)/b22-19-,28-27+
InChIKey PNHUVPQEWLEWQB-XVHGHVALSA-N
Mol Weight 742.3 g/mol
Molecular Formula C39H79NO6Si3
Exact Mass 741.521519 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0SMzlIBNNg
Name DMIPS-ether derivative of 11-dtxb2-methyl ester-11-n-propylamide
Alternate Name(s) 8-(1-(dimethylisopropylsiloxy)-2-(propylaminocarbonyl)ethyl)-9,12-di(dimethylisopropylsiloxy)heptadeca-5(Z),10(E)-dienoic acid methyl ester Methyl (5Z,10E)-9,12-bis{[isopropyl(dimethyl)silyl]oxy}-8-[1-{[isopropyl(dimethyl)silyl]oxy}-3-oxo-3-(propylamino)propyl]-5,10-heptadecadienoate
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Formula C39H79NO6Si3
InChI InChI=1S/C39H79NO6Si3/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/h19,22,27-28,31-37H,16-18,20-21,23-26,29-30H2,1-15H3,(H,40,41)/b22-19-,28-27+
InChIKey PNHUVPQEWLEWQB-XVHGHVALSA-N
Molecular Weight 742.317 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)CCCCC)C\C=C/CCCC(=O)OC)=O)CCC
SPLASH splash10-052k-0362239100-33986f120ceafedda5af
Source of Spectrum KO-17-133-1
Wiley ID 1416126