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2-Benzyl-3-tert-butoxycarbonylamino-4-(4-methoxy-phenyl)-butyric acid methyl ester
SpectraBase Compound ID 2iIBrh1qczE
InChI InChI=1S/C24H31NO5/c1-24(2,3)30-23(27)25-21(16-18-11-13-19(28-4)14-12-18)20(22(26)29-5)15-17-9-7-6-8-10-17/h6-14,20-21H,15-16H2,1-5H3,(H,25,27)
InChIKey KEFJOHBXICHDJE-UHFFFAOYSA-N
Mol Weight 413.51 g/mol
Molecular Formula C24H31NO5
Exact Mass 413.220223 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lWhwn2Deqw
Name 2-Benzyl-3-tert-butoxycarbonylamino-4-(4-methoxy-phenyl)-butyric acid methyl ester
Alternate Name(s) Methyl (2R,2S)-2-benzyl-(3S)-3-[(tert-butoxy)carbonylamino]-4-(4-methoxyphenyl)butanoate Methyl 2-benzyl-3-[(tert-butoxycarbonyl)amino]-4-(4-methoxyphenyl)butanoate
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Formula C24H31NO5
InChI InChI=1S/C24H31NO5/c1-24(2,3)30-23(27)25-21(16-18-11-13-19(28-4)14-12-18)20(22(26)29-5)15-17-9-7-6-8-10-17/h6-14,20-21H,15-16H2,1-5H3,(H,25,27)
InChIKey KEFJOHBXICHDJE-UHFFFAOYSA-N
Molecular Weight 413.514 g/mol
SMILES N(C(OC(C)(C)C)=O)C(C(C(=O)OC)Cc1ccccc1)Cc1ccc(cc1)OC
SPLASH splash10-0a4i-9400000000-021687f3661a433a7ff3
Source of Spectrum KD-13-600-18
Wiley ID 1635057