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1-(2-CARBOXYETHYL)-1,3,5-TRIAZINE-2,4,6-TRIONE
SpectraBase Compound ID ENpe4xJEfqG
InChI InChI=1S/C6H7N3O5/c10-3(11)1-2-9-5(13)7-4(12)8-6(9)14/h1-2H2,(H,10,11)(H2,7,8,12,13,14)
InChIKey JGAOCGFZZBDROL-UHFFFAOYSA-N
Mol Weight 201.14 g/mol
Molecular Formula C6H7N3O5
Exact Mass 201.03857 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F9RpeuQQZzG
Name 1-(2-CARBOXYETHYL)-1,3,5-TRIAZINE-2,4,6-TRIONE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H7N3O5
InChI InChI=1S/C6H7N3O5/c10-3(11)1-2-9-5(13)7-4(12)8-6(9)14/h1-2H2,(H,10,11)(H2,7,8,12,13,14)
InChIKey JGAOCGFZZBDROL-UHFFFAOYSA-N
Literature Reference Author M.MASCAL,J.HANSEN,P.S.FALLON,A.J.BLAKE,B.R.HEYWOOD,M.H.MOORE ,J.P.TURKENBURG
Literature Reference Citation CHEM.EUR.J.,5,381(1999)
Literature Reference DOI 10.1002/(sici)1521-3765(19990104)5:1<381::aid-chem381>3.0.co;2-t
Molecular Weight 201.139 g/mol
Solvent DMSO-D6
Source File Reference UWMP15034