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BOYLKQGLCCKVMN-UHFFFAOYSA-N

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BOYLKQGLCCKVMN-UHFFFAOYSA-N
SpectraBase Compound ID 4wfydpvjRA
InChI InChI=1S/C23H22F4N8O5S/c24-17-19(26)22(34-35-28)20(27)18(25)21(17)30-7-6-29-13(36)8-31-14(37)9-32-15(38)10-33-16(39)11-41-23(40)12-4-2-1-3-5-12/h1-5,30H,6-11H2,(H,29,36)(H,31,37)(H,32,38)(H,33,39)
InChIKey BOYLKQGLCCKVMN-UHFFFAOYSA-N
Mol Weight 598.53 g/mol
Molecular Formula C23H22F4N8O5S
Exact Mass 598.137 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GRVkP43Z5Zn
Name BOYLKQGLCCKVMN-UHFFFAOYSA-N
Compound Number 5A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22F4N8O5S
InChI InChI=1S/C23H22F4N8O5S/c24-17-19(26)22(34-35-28)20(27)18(25)21(17)30-7-6-29-13(36)8-31-14(37)9-32-15(38)10-33-16(39)11-41-23(40)12-4-2-1-3-5-12/h1-5,30H,6-11H2,(H,29,36)(H,31,37)(H,32,38)(H,33,39)
InChIKey BOYLKQGLCCKVMN-UHFFFAOYSA-N
Literature Reference Author R.RAJAGOPALAN,R.R.KUNTZ,U.SHARMA,W.A.VOLKERT,R.S.PANDURANGI
Literature Reference Citation J.ORG.CHEM.,67,6748(2002)
Literature Reference DOI 10.1021/jo010782u
Solvent DMSO
Source File Reference UWSI22087