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(2S,3R)-2-(benzyloxycarbonylamino)-3-(4-nitrophenyl)butyric acid tert-butyl ester
SpectraBase Compound ID 4hNs3KPGvwV
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+/m1/s1
InChIKey BXPVRRKGGOUGBR-BEFAXECRSA-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 54MjkSavGyD
Name (2S,3R)-2-(benzyloxycarbonylamino)-3-(4-nitrophenyl)butyric acid tert-butyl ester
Alternate Name(s) (2S,3R)-3-(4-nitrophenyl)-2-(phenylmethoxycarbonylamino)butanoic acid tert-butyl ester tert-Butyl (2S,3R)-3-(4-nitrophenyl)-2-(phenylmethoxycarbonylamino)butanoate
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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+/m1/s1
InChIKey BXPVRRKGGOUGBR-BEFAXECRSA-N
Molecular Weight 414.458 g/mol
SMILES N([C@](C(=O)OC(C)(C)C)([C@](C)(c1ccc(cc1)N(=O)=O)[H])[H])C(=O)OCc1ccccc1
SPLASH splash10-01ox-9004100000-85c90d79ea8987cc8ef9
Source of Spectrum K-2002-2847-10
Wiley ID 1613358