| SpectraBase Compound ID | 3Uqx3si6cNg |
|---|---|
| InChI | InChI=1S/C8H9NO5S/c1-14-8-4-3-6(15(2,12)13)5-7(8)9(10)11/h3-5H,1-2H3 |
| InChIKey | NPQPEWSDPMSLMR-UHFFFAOYSA-N |
| Mol Weight | 231.22 g/mol |
| Molecular Formula | C8H9NO5S |
| Exact Mass | 231.020144 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4J2emA2mv5U |
|---|---|
| Name | 4-(METHYLSULFONYL)-2-NITROANISOLE |
| Source of Sample | Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H9NO5S |
| InChI | InChI=1S/C8H9NO5S/c1-14-8-4-3-6(15(2,12)13)5-7(8)9(10)11/h3-5H,1-2H3 |
| InChIKey | NPQPEWSDPMSLMR-UHFFFAOYSA-N |
| Molecular Weight | 231.23 |
| Solvent | Polysol; Reference=TMS Spectrometer= Bruker AC-300 |
| Synonyms | ANISOLE, 4-/METHYLSULFONYL/- 2-NITRO-, |