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3-{[(2,6-Dimethylpyrimidin-4-yl)amino]methylene}-2-hydroxy-2-(trifluoromethyl)chroman-4-one
SpectraBase Compound ID He7PlrvdJEu
InChI InChI=1S/C17H14F3N3O3/c1-9-7-14(23-10(2)22-9)21-8-12-15(24)11-5-3-4-6-13(11)26-16(12,25)17(18,19)20/h3-8,25H,1-2H3,(H,21,22,23)/b12-8-
InChIKey QWDJJJLMVXHFSA-WQLSENKSSA-N
Mol Weight 365.31 g/mol
Molecular Formula C17H14F3N3O3
Exact Mass 365.098726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A95JEqzGBE7
Name 3-{[(2,6-Dimethylpyrimidin-4-yl)amino]methylene}-2-hydroxy-2-(trifluoromethyl)chroman-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14F3N3O3
InChI InChI=1S/C17H14F3N3O3/c1-9-7-14(23-10(2)22-9)21-8-12-15(24)11-5-3-4-6-13(11)26-16(12,25)17(18,19)20/h3-8,25H,1-2H3,(H,21,22,23)/b12-8-
InChIKey QWDJJJLMVXHFSA-WQLSENKSSA-N
Molecular Weight 365.312 g/mol
SMILES OC1(\C(=C/Nc2nc(C)nc(c2)C)C(c2c(O1)cccc2)=O)C(F)(F)F
SPLASH splash10-006t-2951000000-41408229d5ac4a3152f9
Source of Spectrum F4-41-3873-3l
Wiley ID 1673129