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6-(3-Hydroxypropyl)-2,3-dimethyl-7-(pentafluoroethyl)-3,4-dihydro-5H-imidazo[4,5-b]pyridin-5-one
SpectraBase Compound ID 2V9E8Wn9Usj
InChI InChI=1S/C13H14F5N3O2/c1-6-19-9-8(12(14,15)13(16,17)18)7(4-3-5-22)11(23)20-10(9)21(6)2/h22H,3-5H2,1-2H3,(H,20,23)
InChIKey BPUZNIWESFPURC-UHFFFAOYSA-N
Mol Weight 339.27 g/mol
Molecular Formula C13H14F5N3O2
Exact Mass 339.100618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZIhqBGaIV1
Name 6-(3-Hydroxypropyl)-2,3-dimethyl-7-(pentafluoroethyl)-3,4-dihydro-5H-imidazo[4,5-b]pyridin-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14F5N3O2
InChI InChI=1S/C13H14F5N3O2/c1-6-19-9-8(12(14,15)13(16,17)18)7(4-3-5-22)11(23)20-10(9)21(6)2/h22H,3-5H2,1-2H3,(H,20,23)
InChIKey BPUZNIWESFPURC-UHFFFAOYSA-N
Molecular Weight 339.266 g/mol
SMILES N1C(C(CCCO)=C(c2c1[n](c(C)n2)C)C(C(F)(F)F)(F)F)=O
SPLASH splash10-03k9-0195000000-376b22ffd63609e4f49c
Source of Spectrum F4-41-1871-25b
Wiley ID 1672463