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2-Acetylamino-4-phenylamino-butyric acid, 2,6-di-t-butyl-4-methoxy-phenyl ester
SpectraBase Compound ID BM9TKbYul8c
InChI InChI=1S/C27H38N2O4/c1-18(30)29-23(14-15-28-19-12-10-9-11-13-19)25(31)33-24-21(26(2,3)4)16-20(32-8)17-22(24)27(5,6)7/h9-13,16-17,23,28H,14-15H2,1-8H3,(H,29,30)
InChIKey JZBZOTPTEYEWBT-UHFFFAOYSA-N
Mol Weight 454.6 g/mol
Molecular Formula C27H38N2O4
Exact Mass 454.283158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dz9YPKJqDTK
Name 2-Acetylamino-4-phenylamino-butyric acid, 2,6-di-t-butyl-4-methoxy-phenyl ester
Alternate Name(s) (2,6-ditert-butyl-4-methoxy-phenyl) 2-acetamido-4-anilino-butanoate (2,6-ditert-butyl-4-methoxy-phenyl) 2-acetamido-4-phenylazanyl-butanoate 2,6-Ditert-butyl-4-methoxyphenyl 2-(acetylamino)-4-anilinobutanoate 2-Acetamido-4-anilino-butyric acid (2,6-ditert-butyl-4-methoxy-phenyl) ester 2-Acetamido-4-anilinobutanoic acid (2,6-ditert-butyl-4-methoxyphenyl) ester
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Formula C27H38N2O4
InChI InChI=1S/C27H38N2O4/c1-18(30)29-23(14-15-28-19-12-10-9-11-13-19)25(31)33-24-21(26(2,3)4)16-20(32-8)17-22(24)27(5,6)7/h9-13,16-17,23,28H,14-15H2,1-8H3,(H,29,30)
InChIKey JZBZOTPTEYEWBT-UHFFFAOYSA-N
Molecular Weight 454.611 g/mol
SMILES N(C(CCNc1ccccc1)C(=O)Oc1c(cc(cc1C(C)(C)C)OC)C(C)(C)C)C(=O)C
SPLASH splash10-01p9-3590000000-e47f42a0b0440620b141
Wiley ID 1486243