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1,7,13,19-Tetra(3-methylphenyl)-1,7,13,19-tetraaza-4,10,16,22-tetraoxacyclotetraeicosane-2,6,14,18-tetraone
SpectraBase Compound ID 6qkGfvSkeHR
InChI InChI=1S/C44H52N4O8/c1-33-9-5-13-37(25-33)45-17-21-53-22-18-46(38-14-6-10-34(2)26-38)43(51)31-56-32-44(52)48(40-16-8-12-36(4)28-40)20-24-54-23-19-47(39-15-7-11-35(3)27-39)42(50)30-55-29-41(45)49/h5-16,25-28H,17-24,29-32H2,1-4H3
InChIKey VFAOILMETSPKAQ-UHFFFAOYSA-N
Mol Weight 764.9 g/mol
Molecular Formula C44H52N4O8
Exact Mass 764.378515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8BZieDQvaWq
Name 1,7,13,19-Tetra(3-methylphenyl)-1,7,13,19-tetraaza-4,10,16,22-tetraoxacyclotetraeicosane-2,6,14,18-tetraone
Alternate Name(s) 4,10,16,22-tetrakis(3-methylphenyl)-1,7,13,19-tetraoxa-4,10,16,22-tetraazacyclotetracosane-3,11,15,23-tetrone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H52N4O8
InChI InChI=1S/C44H52N4O8/c1-33-9-5-13-37(25-33)45-17-21-53-22-18-46(38-14-6-10-34(2)26-38)43(51)31-56-32-44(52)48(40-16-8-12-36(4)28-40)20-24-54-23-19-47(39-15-7-11-35(3)27-39)42(50)30-55-29-41(45)49/h5-16,25-28H,17-24,29-32H2,1-4H3
InChIKey VFAOILMETSPKAQ-UHFFFAOYSA-N
Molecular Weight 764.920 g/mol
SMILES C1(N(CCOCCN(C(COCC(N(CCOCCN(C(COC1)=O)c1cc(C)ccc1)c1cc(C)ccc1)=O)=O)c1cc(C)ccc1)c1cc(C)ccc1)=O
SPLASH splash10-014i-0000000900-b24fb55e0f4f9457e42a
Source of Spectrum F-55-14477-23
Wiley ID 839987