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bis{2-[Acetoxy(phenyl)methylcarbonyl]amino-3-phenylpropyl}sulfide
SpectraBase Compound ID HuPKmZWIg2T
InChI InChI=1S/C38H40N2O6S/c1-27(41)45-35(31-19-11-5-12-20-31)37(43)39-33(23-29-15-7-3-8-16-29)25-47-26-34(24-30-17-9-4-10-18-30)40-38(44)36(46-28(2)42)32-21-13-6-14-22-32/h3-22,33-36H,23-26H2,1-2H3,(H,39,43)(H,40,44)
InChIKey HFHIQBHDJXBRJL-UHFFFAOYSA-N
Mol Weight 652.8 g/mol
Molecular Formula C38H40N2O6S
Exact Mass 652.260708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJncGtC1XM7
Name bis{2-[Acetoxy(phenyl)methylcarbonyl]amino-3-phenylpropyl}sulfide
Alternate Name(s) 4,8-Dibenzyl-2,10,13-trioxo-1,11-diphenyl-12-oxa-6-thia-3,9-diazatetradec-1-yl acetate
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Formula C38H40N2O6S
InChI InChI=1S/C38H40N2O6S/c1-27(41)45-35(31-19-11-5-12-20-31)37(43)39-33(23-29-15-7-3-8-16-29)25-47-26-34(24-30-17-9-4-10-18-30)40-38(44)36(46-28(2)42)32-21-13-6-14-22-32/h3-22,33-36H,23-26H2,1-2H3,(H,39,43)(H,40,44)
InChIKey HFHIQBHDJXBRJL-UHFFFAOYSA-N
Molecular Weight 652.806 g/mol
SMILES N(C(C(OC(=O)C)c1ccccc1)=O)C(CSCC(NC(C(OC(=O)C)c1ccccc1)=O)Cc1ccccc1)Cc1ccccc1
SPLASH splash10-03xr-3419001000-5931a813bec0d102a95c
Source of Spectrum U-1997-1356-6
Wiley ID 769791