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11-Benzyloxycarbonylamino-1-phthalimido-4,8-ditosyl-4,8-diazaundecane
SpectraBase Compound ID A1xkKQv06LU
InChI InChI=1S/C39H44N4O8S2/c1-30-15-19-33(20-16-30)52(47,48)41(24-8-23-40-39(46)51-29-32-11-4-3-5-12-32)25-9-26-42(53(49,50)34-21-17-31(2)18-22-34)27-10-28-43-37(44)35-13-6-7-14-36(35)38(43)45/h3-7,11-22H,8-10,23-29H2,1-2H3,(H,40,46)
InChIKey UGJODTDDLRXVHS-UHFFFAOYSA-N
Mol Weight 760.9 g/mol
Molecular Formula C39H44N4O8S2
Exact Mass 760.260057 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8doQK8tCz9
Name 11-Benzyloxycarbonylamino-1-phthalimido-4,8-ditosyl-4,8-diazaundecane
Alternate Name(s) benzyl 3-{(3-{[3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propyl][(4-methylphenyl)sulfonyl]amino}propyl)[(4-methylphenyl)sulfonyl]amino}propylcarbamate
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Formula C39H44N4O8S2
InChI InChI=1S/C39H44N4O8S2/c1-30-15-19-33(20-16-30)52(47,48)41(24-8-23-40-39(46)51-29-32-11-4-3-5-12-32)25-9-26-42(53(49,50)34-21-17-31(2)18-22-34)27-10-28-43-37(44)35-13-6-7-14-36(35)38(43)45/h3-7,11-22H,8-10,23-29H2,1-2H3,(H,40,46)
InChIKey UGJODTDDLRXVHS-UHFFFAOYSA-N
Molecular Weight 760.921 g/mol
SMILES N(C(=O)OCc1ccccc1)CCCN(S(c1ccc(cc1)C)(=O)=O)CCCN(S(c1ccc(cc1)C)(=O)=O)CCCN1C(c2ccccc2C1=O)=O
SPLASH splash10-052f-9320000000-34ad8783b2f3fb0a2846
Source of Spectrum H-62-2322-0
Wiley ID 1416510