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syn-Methyl (S)-3-[N-phenyl-N-((S)-N',N'-phthaloyl-tert-leucyl)]amino-3-(2',4',6'-trimethylphenyl)-(R)-2-methoxypropionate

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syn-Methyl (S)-3-[N-phenyl-N-((S)-N',N'-phthaloyl-tert-leucyl)]amino-3-(2',4',6'-trimethylphenyl)-(R)-2-methoxypropionate
SpectraBase Compound ID AeOk9TaB2rH
InChI InChI=1S/C34H38N2O6/c1-20-18-21(2)26(22(3)19-20)27(28(41-7)33(40)42-8)35(23-14-10-9-11-15-23)32(39)29(34(4,5)6)36-30(37)24-16-12-13-17-25(24)31(36)38/h9-19,27-29H,1-8H3/t27-,28+,29-/m1/s1
InChIKey XMQDNPLNDUKFHS-SSBOKUKZSA-N
Mol Weight 570.7 g/mol
Molecular Formula C34H38N2O6
Exact Mass 570.272987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZvP2Z5A7vQ
Name syn-Methyl (S)-3-[N-phenyl-N-((S)-N',N'-phthaloyl-tert-leucyl)]amino-3-(2',4',6'-trimethylphenyl)-(R)-2-methoxypropionate
Alternate Name(s) Methyl (2S,3R)-3-{[(2S)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3,3-dimethylbutanoyl]anilino}-3-mesityl-2-methoxypropanoate
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Formula C34H38N2O6
InChI InChI=1S/C34H38N2O6/c1-20-18-21(2)26(22(3)19-20)27(28(41-7)33(40)42-8)35(23-14-10-9-11-15-23)32(39)29(34(4,5)6)36-30(37)24-16-12-13-17-25(24)31(36)38/h9-19,27-29H,1-8H3/t27-,28+,29-/m1/s1
InChIKey XMQDNPLNDUKFHS-SSBOKUKZSA-N
Molecular Weight 570.686 g/mol
SMILES C1(N(C(c2ccccc12)=O)[C@](C(N([C@@]([C@@](C(=O)OC)(OC)[H])(c1c(cc(cc1C)C)C)[H])c1ccccc1)=O)(C(C)(C)C)[H])=O
SPLASH splash10-014i-0090300000-e70b98530a157719373d
Source of Spectrum QE-6-2041-14
Wiley ID 844754