3-(1,3-benzodioxol-5-yl)-N-[2-fluoro-5-(trifluoromethyl)phenyl]-6-methylisoxazolo[5,4-b]pyridine-4-carboxamide

SpectraBase Compound ID	AnGS21HMzQz
InChI	InChI=1S/C22H13F4N3O4/c1-10-6-13(20(30)28-15-8-12(22(24,25)26)3-4-14(15)23)18-19(29-33-21(18)27-10)11-2-5-16-17(7-11)32-9-31-16/h2-8H,9H2,1H3,(H,28,30)
InChIKey	WUVVQKJHUJDLCE-UHFFFAOYSA-N Google Search
Mol Weight	459.36 g/mol
Molecular Formula	C22H13F4N3O4
Exact Mass	459.084219 g/mol

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SpectraBase Spectrum ID	AiEQTC5fsvG
Name	3-(1,3-benzodioxol-5-yl)-N-[2-fluoro-5-(trifluoromethyl)phenyl]-6-methylisoxazolo[5,4-b]pyridine-4-carboxamide
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C22H13F4N3O4/c1-10-6-13(20(30)28-15-8-12(22(24,25)26)3-4-14(15)23)18-19(29-33-21(18)27-10)11-2-5-16-17(7-11)32-9-31-16/h2-8H,9H2,1H3,(H,28,30)
InChIKey	WUVVQKJHUJDLCE-UHFFFAOYSA-N
NMR Offset	17.9122
NMR Spectrometer Frequency	500.077
Observed nucleus	1H
Origin	1H_SBI_36227_33838
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 1996628; SBI_ID: SBI-033842
Temperature	303 °C