{4-[(Z)-(1-[2-(1-cyclohexen-1-yl)ethyl]-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetic acid

SpectraBase Compound ID	6BeFAhSJMgD
InChI	InChI=1S/C21H22N2O6/c24-18(25)13-29-16-8-6-15(7-9-16)12-17-19(26)22-21(28)23(20(17)27)11-10-14-4-2-1-3-5-14/h4,6-9,12H,1-3,5,10-11,13H2,(H,24,25)(H,22,26,28)/b17-12-
InChIKey	FWHAMCWARVBIQQ-ATVHPVEESA-N Google Search
Mol Weight	398.42 g/mol
Molecular Formula	C21H22N2O6
Exact Mass	398.147786 g/mol

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SpectraBase Spectrum ID	1WYJq0kG8SC
Name	{4-[(Z)-(1-[2-(1-cyclohexen-1-yl)ethyl]-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetic acid
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/C21H22N2O6/c24-18(25)13-29-16-8-6-15(7-9-16)12-17-19(26)22-21(28)23(20(17)27)11-10-14-4-2-1-3-5-14/h4,6-9,12H,1-3,5,10-11,13H2,(H,24,25)(H,22,26,28)/b17-12-
InChIKey	FWHAMCWARVBIQQ-ATVHPVEESA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_5373
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/10321800; Labnumber: LP-1708385; IOH_ID: IOH-005374
Synonyms	{4-[(1-[2-(1-cyclohexen-1-yl)ethyl]-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetic acid