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2-[4-[methyl-[[3-[methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-nitrophenyl]methoxy-oxomethyl]amino]phenyl]acetic acid methyl ester
SpectraBase Compound ID 3TUuxPprlIf
InChI InChI=1S/C24H29N3O8/c1-24(2,3)35-23(30)26(5)20-13-17(9-12-19(20)27(31)32)15-34-22(29)25(4)18-10-7-16(8-11-18)14-21(28)33-6/h7-13H,14-15H2,1-6H3
InChIKey NYHNCFNXWWFGBN-UHFFFAOYSA-N
Mol Weight 487.51 g/mol
Molecular Formula C24H29N3O8
Exact Mass 487.195465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2R27IAqKhrD
Name 2-[4-[methyl-[[3-[methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-nitrophenyl]methoxy-oxomethyl]amino]phenyl]acetic acid methyl ester
Alternate Name(s) 2-[4-[[3-[tert-butoxycarbonyl(methyl)amino]-4-nitro-benzyl]oxycarbonyl-methyl-amino]phenyl]acetic acid methyl ester Methyl 2-[4-[methyl-[[3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-nitro-phenyl]methoxycarbonyl]amino]phenyl]ethanoate Methyl 2-[4-[methyl-[[3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-nitrophenyl]methoxycarbonyl]amino]phenyl]acetate Methyl 2-[4-[[3-[tert-butoxycarbonyl(methyl)amino]-4-nitro-phenyl]methoxycarbonyl-methyl-amino]phenyl]acetate
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Formula C24H29N3O8
InChI InChI=1S/C24H29N3O8/c1-24(2,3)35-23(30)26(5)20-13-17(9-12-19(20)27(31)32)15-34-22(29)25(4)18-10-7-16(8-11-18)14-21(28)33-6/h7-13H,14-15H2,1-6H3
InChIKey NYHNCFNXWWFGBN-UHFFFAOYSA-N
Molecular Weight 487.509 g/mol
SMILES c1(N(=O)=O)c(N(C(OC(C)(C)C)=O)C)cc(cc1)COC(N(c1ccc(CC(=O)OC)cc1)C)=O
SPLASH splash10-0ar9-7904100000-4418e0ed247cb2cd85c5
Source of Spectrum KC-0-2767-28
Wiley ID 829120