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5-(4-(4-Methoxybutoxy)benzyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
SpectraBase Compound ID 5SaQxBg5Kcw
InChI InChI=1S/C16H20N2O4S/c1-21-8-2-3-9-22-12-6-4-11(5-7-12)10-13-14(19)17-16(23)18-15(13)20/h4-7,13H,2-3,8-10H2,1H3,(H2,17,18,19,20,23)
InChIKey FVXITWMJMRGSDU-UHFFFAOYSA-N
Mol Weight 336.41 g/mol
Molecular Formula C16H20N2O4S
Exact Mass 336.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMinpP9kN18
Name 5-(4-(4-Methoxybutoxy)benzyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Alternate Name(s) 5-[[4-(4-methoxybutoxy)phenyl]methyl]-2-thioxo-hexahydropyrimidine-4,6-dione 5-[[4-(4-methoxybutoxy)phenyl]methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O4S
InChI InChI=1S/C16H20N2O4S/c1-21-8-2-3-9-22-12-6-4-11(5-7-12)10-13-14(19)17-16(23)18-15(13)20/h4-7,13H,2-3,8-10H2,1H3,(H2,17,18,19,20,23)
InChIKey FVXITWMJMRGSDU-UHFFFAOYSA-N
Molecular Weight 336.406 g/mol
SMILES N1C(C(C(=O)NC1=S)Cc1ccc(cc1)OCCCCOC)=O
SPLASH splash10-052r-9404000000-25af2f6be8dcd7f08dd1
Source of Spectrum F2-44-4242-4f
Wiley ID 1706013