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(2S,3S)-3-[[(1S)-1-carbobenzoxy-3-methyl-butyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester
SpectraBase Compound ID 51yJjF2ONUZ
InChI InChI=1S/C19H26N2O5/c1-4-25-19(24)16-15(21-16)17(22)20-14(10-12(2)3)18(23)26-11-13-8-6-5-7-9-13/h5-9,12,14-16,21H,4,10-11H2,1-3H3,(H,20,22)/t14-,15-,16-/m0/s1
InChIKey WBOFUGRDYWLSCL-JYJNAYRXSA-N
Mol Weight 362.43 g/mol
Molecular Formula C19H26N2O5
Exact Mass 362.184172 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CNb2ac7TBLs
Name (2S,3S)-3-[[(1S)-1-carbobenzoxy-3-methyl-butyl]carbamoyl]ethylenimine-2-carboxylic acid ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.184171940 u
Formula C19H26N2O5
InChI InChI=1S/C19H26N2O5/c1-4-25-19(24)16-15(21-16)17(22)20-14(10-12(2)3)18(23)26-11-13-8-6-5-7-9-13/h5-9,12,14-16,21H,4,10-11H2,1-3H3,(H,20,22)/t14-,15-,16-/m0/s1
InChIKey WBOFUGRDYWLSCL-JYJNAYRXSA-N
Molecular Weight 362.426 g/mol
SMILES [C@@]1([C@@](C(=O)OCC)(N1)[H])(C(N[C@](C(OCC=1C=CC=CC1)=O)(CC(C)C)[H])=O)[H]