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7,16-Bis[4-(1-oxo-2-phenylselenylpropyl)phenyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
SpectraBase Compound ID EOTN7URLXIl
InChI InChI=1S/C42H50N2O6Se2/c1-33(51-39-9-5-3-6-10-39)41(45)35-13-17-37(18-14-35)43-21-25-47-29-31-49-27-23-44(24-28-50-32-30-48-26-22-43)38-19-15-36(16-20-38)42(46)34(2)52-40-11-7-4-8-12-40/h3-20,33-34H,21-32H2,1-2H3
InChIKey IXJQGNRDFIAJBM-UHFFFAOYSA-N
Mol Weight 836.8 g/mol
Molecular Formula C42H50N2O6Se2
Exact Mass 838.199931 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fky4g0ZiInR
Name 7,16-Bis[4-(1-oxo-2-phenylselenylpropyl)phenyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
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Formula C42H50N2O6Se2
InChI InChI=1S/C42H50N2O6Se2/c1-33(51-39-9-5-3-6-10-39)41(45)35-13-17-37(18-14-35)43-21-25-47-29-31-49-27-23-44(24-28-50-32-30-48-26-22-43)38-19-15-36(16-20-38)42(46)34(2)52-40-11-7-4-8-12-40/h3-20,33-34H,21-32H2,1-2H3
InChIKey IXJQGNRDFIAJBM-UHFFFAOYSA-N
Molecular Weight 836.814 g/mol
SMILES c1(N2CCOCCOCCN(CCOCCOCC2)c2ccc(C(C([Se]c3ccccc3)C)=O)cc2)ccc(C(C([Se]c2ccccc2)C)=O)cc1
SPLASH splash10-0kaj-0920401000-43d47ed9ec55af859dc4
Source of Spectrum F-55-5223-25
Synonyms 2-(Phenylselanyl)-1-[4-(16-{4-[2-(phenylselanyl)propanoyl]phenyl}-1,4,10,13-tetraoxa-7,16-diazacyclooctadecan-7-yl)phenyl]propan-1-one
Wiley ID 837838