| SpectraBase Compound ID | 2D722v3cdaj |
|---|---|
| InChI | InChI=1S/C7H7NO3S/c1-12(11)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3 |
| InChIKey | MLTFFVSGGPGNSP-UHFFFAOYSA-N |
| Mol Weight | 185.2 g/mol |
| Molecular Formula | C7H7NO3S |
| Exact Mass | 185.014664 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2Q1njx0Mk7p |
|---|---|
| Name | BENZENE, 1-(METHYLSULFINYL)-4-NITRO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H7NO3S |
| InChI | InChI=1S/C7H7NO3S/c1-12(11)7-4-2-6(3-5-7)8(9)10/h2-5H,1H3 |
| InChIKey | MLTFFVSGGPGNSP-UHFFFAOYSA-N |
| Instrument Name | VARIAN XL-100 |
| NMR Standard | TMS |
| Solvent | CDCL3 |