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N-(tert-Butyloxycarbonyl)-(.beta.-tert-butyl ester)-L-aspartyl-(E)-1-amino-2-methylcyclopropanecarboxylic Acid Methyl Ester
SpectraBase Compound ID HQb7A4m6RVD
InChI InChI=1S/C19H32N2O7/c1-11-10-19(11,15(24)26-8)21-14(23)12(9-13(22)27-17(2,3)4)20-16(25)28-18(5,6)7/h11-12H,9-10H2,1-8H3,(H,20,25)(H,21,23)/t11-,12-,19+/m0/s1
InChIKey QASULDDAZPYKDO-SYTFOFBDSA-N
Mol Weight 400.5 g/mol
Molecular Formula C19H32N2O7
Exact Mass 400.220951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5iY3Pyfq9Bq
Name N-(tert-Butyloxycarbonyl)-(.beta.-tert-butyl ester)-L-aspartyl-(E)-1-amino-2-methylcyclopropanecarboxylic Acid Methyl Ester
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Formula C19H32N2O7
InChI InChI=1S/C19H32N2O7/c1-11-10-19(11,15(24)26-8)21-14(23)12(9-13(22)27-17(2,3)4)20-16(25)28-18(5,6)7/h11-12H,9-10H2,1-8H3,(H,20,25)(H,21,23)/t11-,12-,19+/m0/s1
InChIKey QASULDDAZPYKDO-SYTFOFBDSA-N
Molecular Weight 400.472 g/mol
SMILES N([C@@]1(C[C@@]1(C)[H])C(=O)OC)C([C@](CC(OC(C)(C)C)=O)(NC(OC(C)(C)C)=O)[H])=O
SPLASH splash10-000i-0091400000-19e33fb3c47eb4057dd4
Source of Spectrum J-57-1080-0
Synonyms Methyl (1R,2S)-1-({(2S)-4-tert-butoxy-2-[(tert-butoxycarbonyl)amino]-4-oxobutanoyl}amino)-2-methylcyclopropanecarboxylate
Wiley ID 1369282