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Hexanamide, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-[3-hydroxy-4-[[[(4-methylphenyl)amino]carbonyl]amino]phenyl]-
SpectraBase Compound ID Aiso2FBNlJw
InChI InChI=1S/C36H49N3O4/c1-9-12-13-32(43-31-21-16-25(35(5,6)10-2)22-28(31)36(7,8)11-3)33(41)37-27-19-20-29(30(40)23-27)39-34(42)38-26-17-14-24(4)15-18-26/h14-23,32,40H,9-13H2,1-8H3,(H,37,41)(H2,38,39,42)
InChIKey NXZJVXDRYXRUPA-UHFFFAOYSA-N
Mol Weight 587.8 g/mol
Molecular Formula C36H49N3O4
Exact Mass 587.372307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FpB49v9RcWY
Name Hexanamide, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-[3-hydroxy-4-[[[(4-methylphenyl)amino]carbonyl]amino]phenyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H49N3O4
InChI InChI=1S/C36H49N3O4/c1-9-12-13-32(43-31-21-16-25(35(5,6)10-2)22-28(31)36(7,8)11-3)33(41)37-27-19-20-29(30(40)23-27)39-34(42)38-26-17-14-24(4)15-18-26/h14-23,32,40H,9-13H2,1-8H3,(H,37,41)(H2,38,39,42)
InChIKey NXZJVXDRYXRUPA-UHFFFAOYSA-N
Molecular Weight 587.805 g/mol
SMILES N(C(C(CCCC)Oc1ccc(cc1C(C)(C)CC)C(C)(C)CC)=O)c1ccc(c(c1)O)NC(=O)Nc1ccc(C)cc1
SPLASH splash10-0pb9-6970400000-cbbd1da52fb372e5a167
Source of Spectrum JX-2015-4-1272
Synonyms 2-(2,4-di-tert-pentylphenoxy)-N-(3-hydroxy-4-(3-(p-tolyl)ureido)phenyl)hexanamide 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(3-hydroxy-4-{[(4-methylphenyl)carbamoyl]amino}phenyl)hexanamide 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[3-hydroxy-4-[[(4-methylanilino)-oxomethyl]amino]phenyl]hexanamide 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[3-hydroxy-4-[(4-methylphenyl)carbamoylamino]phenyl]hexanamide 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-[3-hydroxy-4-(p-tolylcarbamoylamino)phenyl]hexanamide 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[(4-methylphenyl)carbamoylamino]-3-oxidanyl-phenyl]hexanamide
Wiley ID 1726663