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(S)-Methyl 2-{2-[1-(Benzyloxycarbonylamino)-2-methylpropyl]-5-methyloxazole-4-ylcarbonylamino}-3-oxobutanoate
SpectraBase Compound ID 4hrLDczFfzY
InChI InChI=1S/C22H27N3O7/c1-12(2)16(25-22(29)31-11-15-9-7-6-8-10-15)20-24-18(14(4)32-20)19(27)23-17(13(3)26)21(28)30-5/h6-10,12,16-17H,11H2,1-5H3,(H,23,27)(H,25,29)/t16?,17-/m0/s1
InChIKey UDDWOHRQKPDHMA-DJNXLDHESA-N
Mol Weight 445.47 g/mol
Molecular Formula C22H27N3O7
Exact Mass 445.1849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID q6M1jx7V7e
Name (S)-Methyl 2-{2-[1-(Benzyloxycarbonylamino)-2-methylpropyl]-5-methyloxazole-4-ylcarbonylamino}-3-oxobutanoate
Alternate Name(s) Methyl (2S)-2-({[2-(1-{[(benzyloxy)carbonyl]amino}-2-methylpropyl)-5-methyl-1,3-oxazol-4-yl]carbonyl}amino)-3-oxobutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27N3O7
InChI InChI=1S/C22H27N3O7/c1-12(2)16(25-22(29)31-11-15-9-7-6-8-10-15)20-24-18(14(4)32-20)19(27)23-17(13(3)26)21(28)30-5/h6-10,12,16-17H,11H2,1-5H3,(H,23,27)(H,25,29)/t16?,17-/m0/s1
InChIKey UDDWOHRQKPDHMA-DJNXLDHESA-N
Molecular Weight 445.472 g/mol
SMILES N(C(=O)OCc1ccccc1)C(c1nc(C(N[C@](C(=O)OC)(C(=O)C)[H])=O)c(o1)C)C(C)C
SPLASH splash10-0006-9231200000-24c92d912d7763339280
Source of Spectrum KC-0-598-16
Wiley ID 824468