glutamine, N~2~-[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]-

SpectraBase Compound ID	47X1rFzKe8l
InChI	InChI=1S/C16H16ClN3O5/c1-8-13(14(20-25-8)9-4-2-3-5-10(9)17)15(22)19-11(16(23)24)6-7-12(18)21/h2-5,11H,6-7H2,1H3,(H2,18,21)(H,19,22)(H,23,24)
InChIKey	NXEMZXBNHFUICE-UHFFFAOYSA-N Google Search
Mol Weight	365.77 g/mol
Molecular Formula	C16H16ClN3O5
Exact Mass	365.077848 g/mol

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SpectraBase Spectrum ID	In9LnhDQaBH
Name	glutamine, N~2~-[[3-(2-chlorophenyl)-5-methyl-4-isoxazolyl]carbonyl]-
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C16H16ClN3O5/c1-8-13(14(20-25-8)9-4-2-3-5-10(9)17)15(22)19-11(16(23)24)6-7-12(18)21/h2-5,11H,6-7H2,1H3,(H2,18,21)(H,19,22)(H,23,24)
InChIKey	NXEMZXBNHFUICE-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_5036
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: NMR/12218189