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(S)-N-(m-(2,4,6-Triisopropylbenzoyl)benzoyl)-L-phenylalanine Methyl Ester
SpectraBase Compound ID 7ZohsexEBMO
InChI InChI=1S/C33H39NO4/c1-20(2)26-18-27(21(3)4)30(28(19-26)22(5)6)31(35)24-14-11-15-25(17-24)32(36)34-29(33(37)38-7)16-23-12-9-8-10-13-23/h8-15,17-22,29H,16H2,1-7H3,(H,34,36)/t29-/m0/s1
InChIKey GGKLMZFYCFIVGJ-LJAQVGFWSA-N
Mol Weight 513.7 g/mol
Molecular Formula C33H39NO4
Exact Mass 513.287909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G75jfgNMgzV
Name (S)-N-(m-(2,4,6-Triisopropylbenzoyl)benzoyl)-L-phenylalanine Methyl Ester
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Formula C33H39NO4
InChI InChI=1S/C33H39NO4/c1-20(2)26-18-27(21(3)4)30(28(19-26)22(5)6)31(35)24-14-11-15-25(17-24)32(36)34-29(33(37)38-7)16-23-12-9-8-10-13-23/h8-15,17-22,29H,16H2,1-7H3,(H,34,36)/t29-/m0/s1
InChIKey GGKLMZFYCFIVGJ-LJAQVGFWSA-N
Molecular Weight 513.678 g/mol
SMILES N(C(c1cc(C(c2c(cc(cc2C(C)C)C(C)C)C(C)C)=O)ccc1)=O)[C@](C(=O)OC)(Cc1ccccc1)[H]
SPLASH splash10-0a4i-0009000000-f94401244386131248da
Source of Spectrum J-63-5645-1
Synonyms Methyl (2S)-3-phenyl-2-{[3-(2,4,6-triisopropylbenzoyl)benzoyl]amino}propanoate (2S)-2-[[oxo-[3-[oxo-[2,4,6-tri(propan-2-yl)phenyl]methyl]phenyl]methyl]amino]-3-phenylpropanoic acid methyl ester Methyl (2S)-3-phenyl-2-[[3-[2,4,6-tri(propan-2-yl)benzoyl]benzoyl]amino]propanoate Methyl (2S)-3-phenyl-2-[[3-(2,4,6-triisopropylbenzoyl)benzoyl]amino]propanoate Methyl (2S)-3-phenyl-2-[[3-[2,4,6-tri(propan-2-yl)phenyl]carbonylphenyl]carbonylamino]propanoate
Wiley ID 1400997