SpectraBase Compound ID | 7kkvMnSvxNw |
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InChI | InChI=1S/C13H8ClNO6S/c14-9-2-4-10(5-3-9)22(20,21)12-6-1-8(13(16)17)7-11(12)15(18)19/h1-7H,(H,16,17) |
InChIKey | DSDQINSEXWXTEC-UHFFFAOYSA-N |
Mol Weight | 341.72 g/mol |
Molecular Formula | C13H8ClNO6S |
Exact Mass | 340.976086 g/mol |
SpectraBase Spectrum ID | 9b2XrX8GXeE |
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Name | 4-[(p-chlorophenyl)sulfonyl]-3-nitrobenzoic acid |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H8ClNO6S |
InChI | InChI=1S/C13H8ClNO6S/c14-9-2-4-10(5-3-9)22(20,21)12-6-1-8(13(16)17)7-11(12)15(18)19/h1-7H,(H,16,17) |
InChIKey | DSDQINSEXWXTEC-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 48770M |
Solvent | DMSO-d6 |