SpectraBase Compound ID | 1qjcz28TVV6 |
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InChI | InChI=1S/C12H10F6N2O2S/c1-2-22-10(21)20-9(23)19-8-4-6(11(13,14)15)3-7(5-8)12(16,17)18/h3-5H,2H2,1H3,(H2,19,20,21,23) |
InChIKey | BOFIDFLVICEYBZ-UHFFFAOYSA-N |
Mol Weight | 360.27 g/mol |
Molecular Formula | C12H10F6N2O2S |
Exact Mass | 360.036718 g/mol |
SpectraBase Spectrum ID | NB1ChECtKr |
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Name | 4-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-3-thioallophanic acid,ethyl ester |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C12H10F6N2O2S |
InChI | InChI=1S/C12H10F6N2O2S/c1-2-22-10(21)20-9(23)19-8-4-6(11(13,14)15)3-7(5-8)12(16,17)18/h3-5H,2H2,1H3,(H2,19,20,21,23) |
InChIKey | BOFIDFLVICEYBZ-UHFFFAOYSA-N |
Sadtler IR Number | 60738 |
Sadtler UV Number | 33662N |
Solvent | Methanol |