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5-[(4-Hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)(4-methoxyphenyl)methyl]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
SpectraBase Compound ID 6VYDxoBOaxo
InChI InChI=1S/C20H20N2O7/c1-10-9-13(23)15(19(26)29-10)14(11-5-7-12(28-4)8-6-11)16-17(24)21(2)20(27)22(3)18(16)25/h5-9,14,16,23H,1-4H3
InChIKey FSAZABSSIFATBR-UHFFFAOYSA-N
Mol Weight 400.39 g/mol
Molecular Formula C20H20N2O7
Exact Mass 400.127051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGsLomtz4Jx
Name 5-[(4-Hydroxy-6-methyl-2-oxo-2H-pyran-3-yl)(4-methoxyphenyl)methyl]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Appearance Yellowish powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20N2O7
InChI InChI=1S/C20H20N2O7/c1-10-9-13(23)15(19(26)29-10)14(11-5-7-12(28-4)8-6-11)16-17(24)21(2)20(27)22(3)18(16)25/h5-9,14,16,23H,1-4H3
InChIKey FSAZABSSIFATBR-UHFFFAOYSA-N
Instrument Name Kratos MS-30
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4609
Molecular Weight 400.387 g/mol
Quality 212
SMILES OC1=C(C(C2=CC=C(C=C2)OC)C2C(N(C(N(C2=O)C)=O)C)=O)C(OC(=C1)C)=O
SPLASH splash10-0006-9480200000-bd6a869826697f869717
Source of Spectrum Y-60-582-2c (DOI: 10.1002/jhet.4609)
Wiley ID 1894517