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5-Methyl-4-[(trimethylacetyl)amino]-1(N)-pentafluorobenzylpyrimidin-2(1H)-one
SpectraBase Compound ID 7pgwK2Evgxd
InChI InChI=1S/C17H16F5N3O2/c1-7-5-25(16(27)24-14(7)23-15(26)17(2,3)4)6-8-9(18)11(20)13(22)12(21)10(8)19/h5H,6H2,1-4H3,(H,23,24,26,27)
InChIKey CZIBHMSGWXUWRP-UHFFFAOYSA-N
Mol Weight 389.33 g/mol
Molecular Formula C17H16F5N3O2
Exact Mass 389.116268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4wi7NBw0ZNZ
Name 5-Methyl-4-[(trimethylacetyl)amino]-1(N)-pentafluorobenzylpyrimidin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16F5N3O2
InChI InChI=1S/C17H16F5N3O2/c1-7-5-25(16(27)24-14(7)23-15(26)17(2,3)4)6-8-9(18)11(20)13(22)12(21)10(8)19/h5H,6H2,1-4H3,(H,23,24,26,27)
InChIKey CZIBHMSGWXUWRP-UHFFFAOYSA-N
Molecular Weight 389.326 g/mol
SMILES N(C1=NC(N(C=C1C)Cc1c(c(F)c(c(c1F)F)F)F)=O)C(C(C)(C)C)=O
SPLASH splash10-0c0r-0904000000-8e64f426957aedeb929d
Source of Spectrum KO-18-965-9
Synonyms 2,2-Dimethyl-N-[5-methyl-2-oxo-1-(2,3,4,5,6-pentafluorobenzyl)-1,2-dihydro-4-pyrimidinyl]propanamide
Wiley ID 1364275