![o-{[3,5-dimethoxy-alpha-(nitromethyl)benzyl]thio}aniline](/api/spectrum/KdVE80C0MhS/structure.png?h=300&w=458 "o-{[3,5-dimethoxy-alpha-(nitromethyl)benzyl]thio}aniline")
| SpectraBase Compound ID | AVt5xNng6hY |
|---|---|
| InChI | InChI=1S/C16H18N2O4S/c1-21-12-7-11(8-13(9-12)22-2)16(10-18(19)20)23-15-6-4-3-5-14(15)17/h3-9,16H,10,17H2,1-2H3 |
| InChIKey | BXZSJLYRQWPWJX-UHFFFAOYSA-N |
| Mol Weight | 334.39 g/mol |
| Molecular Formula | C16H18N2O4S |
| Exact Mass | 334.098728 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KdVE80C0MhS |
|---|---|
| Name | o-{[3,5-dimethoxy-alpha-(nitromethyl)benzyl]thio}aniline |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H18N2O4S |
| InChI | InChI=1S/C16H18N2O4S/c1-21-12-7-11(8-13(9-12)22-2)16(10-18(19)20)23-15-6-4-3-5-14(15)17/h3-9,16H,10,17H2,1-2H3 |
| InChIKey | BXZSJLYRQWPWJX-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 58978M |
| Solvent | CDCl3 |