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1-Pyrimidineacetic acid, 3-(1,3-benzodioxol-5-yl)-1,2,3,6-tetrahydro-4-methyl-2,6-dioxo-, methyl ester
SpectraBase Compound ID dvpB7dRbba
InChI InChI=1S/C15H14N2O6/c1-9-5-13(18)16(7-14(19)21-2)15(20)17(9)10-3-4-11-12(6-10)23-8-22-11/h3-6H,7-8H2,1-2H3
InChIKey SOKPAQUUZYQXFW-UHFFFAOYSA-N
Mol Weight 318.29 g/mol
Molecular Formula C15H14N2O6
Exact Mass 318.085186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8xouSd9V2f
Name 1-Pyrimidineacetic acid, 3-(1,3-benzodioxol-5-yl)-1,2,3,6-tetrahydro-4-methyl-2,6-dioxo-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14N2O6
InChI InChI=1S/C15H14N2O6/c1-9-5-13(18)16(7-14(19)21-2)15(20)17(9)10-3-4-11-12(6-10)23-8-22-11/h3-6H,7-8H2,1-2H3
InChIKey SOKPAQUUZYQXFW-UHFFFAOYSA-N
Molecular Weight 318.285 g/mol
SMILES C(N1C(=O)C=C(N(c2cc3c(cc2)OCO3)C1=O)C)C(=O)OC
SPLASH splash10-0wor-9831000000-76bf118bd68c9f147b91
Source of Spectrum IY-2-4900-3
Synonyms 2-[3-(1,3-benzodioxol-5-yl)-4-methyl-2,6-dioxo-1-pyrimidinyl]acetic acid methyl ester Methyl 2-[3-(1,3-benzodioxol-5-yl)-4-methyl-2,6-dioxopyrimidin-1-yl]acetate Methyl 2-[3-(1,3-benzodioxol-5-yl)-4-methyl-2,6-dioxo-pyrimidin-1-yl]acetate Methyl 2-[3-(1,3-benzodioxol-5-yl)-4-methyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]ethanoate
Wiley ID 1656986