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(S)-(-)-2-tert-butyloxycarbonylamino-3-(2'-quinoxalyl)propionic acid

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(S)-(-)-2-tert-butyloxycarbonylamino-3-(2'-quinoxalyl)propionic acid
SpectraBase Compound ID FTR0stmWkP2
InChI InChI=1S/C16H19N3O4/c1-16(2,3)23-15(22)19-13(14(20)21)8-10-9-17-11-6-4-5-7-12(11)18-10/h4-7,9,13H,8H2,1-3H3,(H,19,22)(H,20,21)/t13-/m0/s1
InChIKey GOPADOFTCYAWLG-ZDUSSCGKSA-N
Mol Weight 317.35 g/mol
Molecular Formula C16H19N3O4
Exact Mass 317.137556 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2FIXymyfA7N
Name (S)-(-)-2-tert-butyloxycarbonylamino-3-(2'-quinoxalyl)propionic acid
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.137556100 u
Formula C16H19N3O4
InChI InChI=1S/C16H19N3O4/c1-16(2,3)23-15(22)19-13(14(20)21)8-10-9-17-11-6-4-5-7-12(11)18-10/h4-7,9,13H,8H2,1-3H3,(H,19,22)(H,20,21)/t13-/m0/s1
InChIKey GOPADOFTCYAWLG-ZDUSSCGKSA-N
Molecular Weight 317.345 g/mol
SMILES C(N[C@](C(=O)O)(CC1=NC2=CC=CC=C2N=C1)[H])(OC(C)(C)C)=O