| SpectraBase Compound ID | IV029xWwxgY |
|---|---|
| InChI | InChI=1S/C11H13NO3S/c1-11(2,3)16-10-5-4-8(7-13)6-9(10)12(14)15/h4-7H,1-3H3 |
| InChIKey | UAGAUIOYQJJWIC-UHFFFAOYSA-N |
| Mol Weight | 239.29 g/mol |
| Molecular Formula | C11H13NO3S |
| Exact Mass | 239.061614 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 7rOBM9eHdQ9 |
|---|---|
| Name | 4-(tert-BUTYLTHIO)-3-NITROBENZALDEHYDE |
| Source of Sample | Bionet Research Ltd., Cornwall, England |
| Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H13NO3S |
| InChI | InChI=1S/C11H13NO3S/c1-11(2,3)16-10-5-4-8(7-13)6-9(10)12(14)15/h4-7H,1-3H3 |
| InChIKey | UAGAUIOYQJJWIC-UHFFFAOYSA-N |
| Instrument Name | BRUKER AC-300 |
| Melting Point | 105-107C |
| Molecular Weight | 239.30 |
| Solvent | DMSO-d6; Reference=TMS; Temperature 297K |