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Pentanamide, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-[4-[[[(4-cyanophenyl)amino]carbonyl]amino]-3-hydroxyphenyl]-
SpectraBase Compound ID 76iBsoiEOXT
InChI InChI=1S/C35H44N4O4/c1-8-11-31(43-30-19-14-24(34(4,5)9-2)20-27(30)35(6,7)10-3)32(41)37-26-17-18-28(29(40)21-26)39-33(42)38-25-15-12-23(22-36)13-16-25/h12-21,31,40H,8-11H2,1-7H3,(H,37,41)(H2,38,39,42)
InChIKey XDADCGJZXPSVBJ-UHFFFAOYSA-N
Mol Weight 584.8 g/mol
Molecular Formula C35H44N4O4
Exact Mass 584.336256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFFsb5wosEt
Name Pentanamide, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-[4-[[[(4-cyanophenyl)amino]carbonyl]amino]-3-hydroxyphenyl]-
Alternate Name(s) N-(4-(3-(4-cyanophenyl)ureido)-3-hydroxyphenyl)-2-(2,4-di-tert-pentylphenoxy)pentanamide 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-{[(4-cyanophenyl)carbamoyl]amino}-3-hydroxyphenyl)pentanamide 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[[(4-cyanoanilino)-oxomethyl]amino]-3-hydroxyphenyl]pentanamide 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[(4-cyanophenyl)carbamoylamino]-3-hydroxyphenyl]pentanamide 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-[4-[(4-cyanophenyl)carbamoylamino]-3-hydroxy-phenyl]pentanamide 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[(4-cyanophenyl)carbamoylamino]-3-oxidanyl-phenyl]pentanamide
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Formula C35H44N4O4
InChI InChI=1S/C35H44N4O4/c1-8-11-31(43-30-19-14-24(34(4,5)9-2)20-27(30)35(6,7)10-3)32(41)37-26-17-18-28(29(40)21-26)39-33(42)38-25-15-12-23(22-36)13-16-25/h12-21,31,40H,8-11H2,1-7H3,(H,37,41)(H2,38,39,42)
InChIKey XDADCGJZXPSVBJ-UHFFFAOYSA-N
Molecular Weight 584.761 g/mol
SMILES N(C(C(CCC)Oc1ccc(cc1C(C)(C)CC)C(C)(C)CC)=O)c1ccc(c(c1)O)NC(=O)Nc1ccc(C#N)cc1
SPLASH splash10-0006-5930300000-9390d9ba521fe8c3ebf0
Source of Spectrum JX-2015-4-1260
Wiley ID 1726651