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Benzoic acid, 4-[[1-oxo-2-[[(phenylmethoxy)carbonyl]amino]propyl]ami no]-, ethyl ester, (S)-
SpectraBase Compound ID LkR5AVNnf7C
InChI InChI=1S/C20H22N2O5/c1-3-26-19(24)16-9-11-17(12-10-16)22-18(23)14(2)21-20(25)27-13-15-7-5-4-6-8-15/h4-12,14H,3,13H2,1-2H3,(H,21,25)(H,22,23)/t14-/m0/s1
InChIKey MNXCXHGHRVWUPY-AWEZNQCLSA-N
Mol Weight 370.41 g/mol
Molecular Formula C20H22N2O5
Exact Mass 370.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbsLm59pdXr
Name Benzoic acid, 4-[[1-oxo-2-[[(phenylmethoxy)carbonyl]amino]propyl]ami no]-, ethyl ester, (S)-
Alternate Name(s) Benzoic acid, p-[2-(carboxyamino)propionamido]-, N-benzyl ethyl ester, L- Ethyl 4-[((2S)-2-{[(benzyloxy)carbonyl]amino}propanoyl)amino]benzoate Ethyl N-(benzyloxycarbonyl)-L-alanyl-4-aminobenzoate
CAS Registry Number 23961-16-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O5
InChI InChI=1S/C20H22N2O5/c1-3-26-19(24)16-9-11-17(12-10-16)22-18(23)14(2)21-20(25)27-13-15-7-5-4-6-8-15/h4-12,14H,3,13H2,1-2H3,(H,21,25)(H,22,23)/t14-/m0/s1
InChIKey MNXCXHGHRVWUPY-AWEZNQCLSA-N
Molecular Weight 370.405 g/mol
SMILES N(C([C@@](NC(=O)OCc1ccccc1)(C)[H])=O)c1ccc(C(=O)OCC)cc1
SPLASH splash10-0006-9610000000-7de903f5b9c9ecf72cbe
Source of Spectrum H-71-150-5
Wiley ID 1354245