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tert-Butyl (2S)-2-(benzyloxycarbonyl)amino-3-(p-nitrophenyl)butanoate
SpectraBase Compound ID 9f8XBLF7t4P
InChI InChI=1S/C22H26N2O6/c1-15(17-10-12-18(13-11-17)24(27)28)19(20(25)30-22(2,3)4)23-21(26)29-14-16-8-6-5-7-9-16/h5-13,15,19H,14H2,1-4H3,(H,23,26)/t15?,19-/m0/s1
InChIKey BXPVRRKGGOUGBR-FUBQLUNQSA-N
Mol Weight 414.46 g/mol
Molecular Formula C22H26N2O6
Exact Mass 414.179087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gBJPqOrebc
Name tert-Butyl (2S)-2-(benzyloxycarbonyl)amino-3-(p-nitrophenyl)butanoate
Alternate Name(s) tert-Butyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-(4-nitrophenyl)butanoate tert-Butyl (2S,3S)-2-(benzyloxycarbonyl)amino-3-(p-nitrophenyl)butanoate isomer
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Formula C22H26N2O6
InChI InChI=1S/C22H26N2O6/c1-15(17-10-12-18(13-11-17)24(27)28)19(20(25)30-22(2,3)4)23-21(26)29-14-16-8-6-5-7-9-16/h5-13,15,19H,14H2,1-4H3,(H,23,26)/t15?,19-/m0/s1
InChIKey BXPVRRKGGOUGBR-FUBQLUNQSA-N
Molecular Weight 414.458 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@](C(OC(C)(C)C)=O)(C(c1ccc(N(=O)=O)cc1)C)[H]
SPLASH splash10-0006-9300000000-712ef5d386b6a9161fe5
Source of Spectrum K-2002-2847-10
Wiley ID 1613357