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Ethyl acetate compound with 4,4'-(1,4-phenylenebis(ethane-2,1-diyl))bis(N,N-di-p-tolylaniline) (1:1)
SpectraBase Compound ID LDTpqiHzj5r
InChI InChI=1S/C50H48N2.C4H8O2/c1-37-5-25-45(26-6-37)51(46-27-7-38(2)8-28-46)49-33-21-43(22-34-49)19-17-41-13-15-42(16-14-41)18-20-44-23-35-50(36-24-44)52(47-29-9-39(3)10-30-47)48-31-11-40(4)12-32-48;1-3-6-4(2)5/h5-16,21-36H,17-20H2,1-4H3;3H2,1-2H3
InChIKey MOOHROWQFYHUAM-UHFFFAOYSA-N
Mol Weight 765.05 g/mol
Molecular Formula C54H56N2O2
Exact Mass 764.434179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JeqGIk1Fp6u
Name Ethyl acetate compound with 4,4'-(1,4-phenylenebis(ethane-2,1-diyl))bis(N,N-di-p-tolylaniline) (1:1)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H56N2O2
InChI InChI=1S/C50H48N2.C4H8O2/c1-37-5-25-45(26-6-37)51(46-27-7-38(2)8-28-46)49-33-21-43(22-34-49)19-17-41-13-15-42(16-14-41)18-20-44-23-35-50(36-24-44)52(47-29-9-39(3)10-30-47)48-31-11-40(4)12-32-48;1-3-6-4(2)5/h5-16,21-36H,17-20H2,1-4H3;3H2,1-2H3
InChIKey MOOHROWQFYHUAM-UHFFFAOYSA-N
Molecular Weight 765.054 g/mol
SMILES Cc1ccc(cc1)N(c1ccc(C)cc1)c1ccc(CCc2ccc(CCc3ccc(cc3)N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)cc1.CCOC(C)=O
SPLASH splash10-002r-0190005000-e7d663e42de87a2acb84
Source of Spectrum JX-2015-4-1491
Wiley ID 1726874