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4-[(1H,3H)-5-METHYLPYRIMIDINE-2,4-DION-1-YL]-1,6-HEPTADIENE
SpectraBase Compound ID 8ytTeNgEN7R
InChI InChI=1S/C12H16N2O2/c1-4-6-10(7-5-2)14-8-9(3)11(15)13-12(14)16/h4-5,8,10H,1-2,6-7H2,3H3,(H,13,15,16)
InChIKey ZNTMDNIWXMJHGI-UHFFFAOYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C12H16N2O2
Exact Mass 220.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJSsZPwNTUx
Name 1-(1-allylbut-3-enyl)-5-methyl-pyrimidine-2,4-dione
Alternate Name(s) 1-(1-allylbut-3-enyl)-5-methyl-pyrimidine-2,4-quinone 1-Hepta-1,6-dien-4-yl-5-methyl-pyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N2O2
InChI InChI=1S/C12H16N2O2/c1-4-6-10(7-5-2)14-8-9(3)11(15)13-12(14)16/h4-5,8,10H,1-2,6-7H2,3H3,(H,13,15,16)
InChIKey ZNTMDNIWXMJHGI-UHFFFAOYSA-N
Molecular Weight 220.272 g/mol
SMILES N1C(C(=CN(C1=O)C(CC=C)CC=C)C)=O
SPLASH splash10-002r-0900000000-2e0db4c53195302307aa
Source of Spectrum F-68-1240-3
Wiley ID 1571801