SpectraBase Compound ID | 5Zf1PSiIgM8 |
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InChI | InChI=1S/C20H11Cl4NO5/c21-13-4-12(5-14(22)6-13)20(26)29-10-11-1-2-19(18(3-11)25(27)28)30-17-8-15(23)7-16(24)9-17/h1-9H,10H2 |
InChIKey | FSMNLNFYMJAELL-UHFFFAOYSA-N |
Mol Weight | 487.1 g/mol |
Molecular Formula | C20H11Cl4NO5 |
Exact Mass | 484.939133 g/mol |
SpectraBase Spectrum ID | HonO24liHMS |
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Name | 4-(3,5-dichlorophenoxy)-3-nitrobenzyl alcohol, 3,5-dichlorobenzoate (ester) |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C20H11Cl4NO5 |
InChI | InChI=1S/C20H11Cl4NO5/c21-13-4-12(5-14(22)6-13)20(26)29-10-11-1-2-19(18(3-11)25(27)28)30-17-8-15(23)7-16(24)9-17/h1-9H,10H2 |
InChIKey | FSMNLNFYMJAELL-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 56232M |
Solvent | CDCl3 |