benzenepropanoic acid, 4-chloro-beta-[[[1-oxo-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propyl]amino]methyl]-, (beta~1~R)-

SpectraBase Compound ID	50fRbQtX9nz
InChI	InChI=1S/C20H19ClN4O4/c21-15-7-5-13(6-8-15)14(11-19(27)28)12-22-18(26)9-10-25-20(29)16-3-1-2-4-17(16)23-24-25/h1-8,14H,9-12H2,(H,22,26)(H,27,28)
InChIKey	NWAPRBKODBKJPW-UHFFFAOYSA-N Google Search
Mol Weight	414.85 g/mol
Molecular Formula	C20H19ClN4O4
Exact Mass	414.109483 g/mol

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SpectraBase Spectrum ID	Kn0ROiobuls
Name	benzenepropanoic acid, 4-chloro-beta-[[[1-oxo-3-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)propyl]amino]methyl]-, (beta~1~R)-
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/C20H19ClN4O4/c21-15-7-5-13(6-8-15)14(11-19(27)28)12-22-18(26)9-10-25-20(29)16-3-1-2-4-17(16)23-24-25/h1-8,14H,9-12H2,(H,22,26)(H,27,28)
InChIKey	NWAPRBKODBKJPW-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_79
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: F02721; Labnumber: ExLab-020662