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Boron, [1-[6-(2,4-dinitrophenoxy)-2-hydroxy-3,4-dimethoxyphenyl]ethanonato]t rifluoro-, (T-4)-
SpectraBase Compound ID 9FOaxIw9FXw
InChI InChI=1S/C16H13BF2N2O9/c1-8(22)14-12(30-17(18)19)7-13(27-2)15(28-3)16(14)29-11-5-4-9(20(23)24)6-10(11)21(25)26/h4-7H,1-3H3
InChIKey PFLINJUGPYQLND-UHFFFAOYSA-N
Mol Weight 426.1 g/mol
Molecular Formula C16H13BF2N2O9
Exact Mass 426.068216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2M3Mutacia
Name Boron, [1-[6-(2,4-dinitrophenoxy)-2-hydroxy-3,4-dimethoxyphenyl]ethanonato]t rifluoro-, (T-4)-
CAS Registry Number 62995-17-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13BF2N2O9
InChI InChI=1S/C16H13BF2N2O9/c1-8(22)14-12(30-17(18)19)7-13(27-2)15(28-3)16(14)29-11-5-4-9(20(23)24)6-10(11)21(25)26/h4-7H,1-3H3
InChIKey PFLINJUGPYQLND-UHFFFAOYSA-N
Molecular Weight 426.092 g/mol
SMILES c1(N(=O)=O)cc(N(=O)=O)ccc1Oc1c(c(OB(F)F)cc(c1OC)OC)C(=O)C
SPLASH splash10-0i30-0933000000-9545ac73ab9b04a540a7
Source of Spectrum KC-1977-435-0
Synonyms 2-Acetyl-3-(2,4-dinitrophenoxy)-4,5-dimethoxyphenyl difluoridoborate 3',4'-Dimethoxy-2'-(2,4-dinitrophenoxy)-6'-difluoroboryloxyacetophenone Ethanone, 1-[6-(2,4-dinitrophenoxy)-2-hydroxy-3,4-dimethoxyphenyl]-, boron complex
Wiley ID 1379776