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2-Phenyl-5-salicyloyl-4-(trifluoromethyl)-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
SpectraBase Compound ID 3d0xC6yVjlt
InChI InChI=1S/C20H12F3N3O3/c21-20(22,23)16-13(17(28)12-8-4-5-9-14(12)27)10-24-18-15(16)19(29)26(25-18)11-6-2-1-3-7-11/h1-10,27H,(H,24,25)
InChIKey IRLLEZCXJFFWTD-UHFFFAOYSA-N
Mol Weight 399.33 g/mol
Molecular Formula C20H12F3N3O3
Exact Mass 399.083076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVg9jP9p3xt
Name 2-Phenyl-5-salicyloyl-4-(trifluoromethyl)-1,2-dihydro-3H-pyrazolo[3,4-b]pyridin-3-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H12F3N3O3
InChI InChI=1S/C20H12F3N3O3/c21-20(22,23)16-13(17(28)12-8-4-5-9-14(12)27)10-24-18-15(16)19(29)26(25-18)11-6-2-1-3-7-11/h1-10,27H,(H,24,25)
InChIKey IRLLEZCXJFFWTD-UHFFFAOYSA-N
Molecular Weight 399.329 g/mol
SMILES N1N(C(c2c(c(C(c3c(cccc3)O)=O)cnc12)C(F)(F)F)=O)c1ccccc1
SPLASH splash10-00aj-6409100000-ae6437a66267b0165f66
Source of Spectrum F4-41-3877-6a
Wiley ID 1673224