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2-(ethylthio)-6-methyl-5-[2-(3-methylphenoxy)ethyl]-1H-pyrimidin-4-one
SpectraBase Compound ID 3RPx8H4xA3I
InChI InChI=1S/C16H20N2O2S/c1-4-21-16-17-12(3)14(15(19)18-16)8-9-20-13-7-5-6-11(2)10-13/h5-7,10H,4,8-9H2,1-3H3,(H,17,18,19)
InChIKey BLVQDJRAEQNSBQ-UHFFFAOYSA-N
Mol Weight 304.41 g/mol
Molecular Formula C16H20N2O2S
Exact Mass 304.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ly96p8ErIO3
Name 2-(ethylthio)-6-methyl-5-[2-(3-methylphenoxy)ethyl]-1H-pyrimidin-4-one
Alternate Name(s) 2-Ethylsulfanyl-6-methyl-5-[2-(3-methylphenoxy)ethyl]-1H-pyrimidin-4-one 3H-Pyrimidin-4-one, 2-ethylsulfanyl-6-methyl-5-(2-m-tolyloxyethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O2S
InChI InChI=1S/C16H20N2O2S/c1-4-21-16-17-12(3)14(15(19)18-16)8-9-20-13-7-5-6-11(2)10-13/h5-7,10H,4,8-9H2,1-3H3,(H,17,18,19)
InChIKey BLVQDJRAEQNSBQ-UHFFFAOYSA-N
Molecular Weight 304.408 g/mol
SMILES N1C(=NC(=C(C1=O)CCOc1cc(C)ccc1)C)SCC
SPLASH splash10-0002-9700000000-b94da9c81a58ee0d0ad1
Wiley ID 1447469