benzoic acid, 4-[2-(ethylamino)-4,5,6,7-tetrahydro-5-oxothiazolo[4,5-b]pyridin-7-yl]-, methyl ester

SpectraBase Compound ID	5M5Aodu7kWR
InChI	InChI=1S/C16H17N3O3S/c1-3-17-16-19-14-13(23-16)11(8-12(20)18-14)9-4-6-10(7-5-9)15(21)22-2/h4-7,11H,3,8H2,1-2H3,(H,17,19)(H,18,20)
InChIKey	GFJSPEKDGVGOGC-UHFFFAOYSA-N Google Search
Mol Weight	331.39 g/mol
Molecular Formula	C16H17N3O3S
Exact Mass	331.099063 g/mol

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SpectraBase Spectrum ID	I30Hngo56Vp
Name	benzoic acid, 4-[2-(ethylamino)-4,5,6,7-tetrahydro-5-oxothiazolo[4,5-b]pyridin-7-yl]-, methyl ester
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/C16H17N3O3S/c1-3-17-16-19-14-13(23-16)11(8-12(20)18-14)9-4-6-10(7-5-9)15(21)22-2/h4-7,11H,3,8H2,1-2H3,(H,17,19)(H,18,20)
InChIKey	GFJSPEKDGVGOGC-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_5356
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/17311613; Labnumber: DUD-801144