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(2RS,3SR)-3-Hydroxy-N-tert-butyl-N(.alpha.)-phthaloyl-p-nitrophenylalaninamide
SpectraBase Compound ID GUvXS9heVoc
InChI InChI=1S/C21H21N3O6/c1-21(2,3)22-18(26)16(17(25)12-8-10-13(11-9-12)24(29)30)23-19(27)14-6-4-5-7-15(14)20(23)28/h4-11,16-17,25H,1-3H3,(H,22,26)
InChIKey ZBSUNJRJHLMEJC-UHFFFAOYSA-N
Mol Weight 411.41 g/mol
Molecular Formula C21H21N3O6
Exact Mass 411.143035 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHEk6ZuKMgT
Name (2RS,3SR)-3-Hydroxy-N-tert-butyl-N(.alpha.)-phthaloyl-p-nitrophenylalaninamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21N3O6
InChI InChI=1S/C21H21N3O6/c1-21(2,3)22-18(26)16(17(25)12-8-10-13(11-9-12)24(29)30)23-19(27)14-6-4-5-7-15(14)20(23)28/h4-11,16-17,25H,1-3H3,(H,22,26)
InChIKey ZBSUNJRJHLMEJC-UHFFFAOYSA-N
Molecular Weight 411.414 g/mol
SMILES N(C(C(C(c1ccc(N(=O)=O)cc1)O)N1C(c2ccccc2C1=O)=O)=O)C(C)(C)C
SPLASH splash10-03dl-0090000000-7cdf1d4b480909efe6a5
Source of Spectrum F-52-7033-0
Synonyms N-(tert-butyl)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-hydroxy-3-(4-nitrophenyl)propanamide
Wiley ID 796701