| SpectraBase Compound ID | KytN1wDkLUJ |
|---|---|
| InChI | InChI=1S/C14H11NO3S/c16-9-12-6-7-14(13(8-12)15(17)18)19-10-11-4-2-1-3-5-11/h1-9H,10H2 |
| InChIKey | UIXPQYSMFXQEMB-UHFFFAOYSA-N |
| Mol Weight | 273.31 g/mol |
| Molecular Formula | C14H11NO3S |
| Exact Mass | 273.045964 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | KTZemXX7Y3S |
|---|---|
| Name | 4-(BENZYLTHIO)-3-NITROBENZALDEHYDE |
| Source of Sample | Bionet Research Ltd., Cornwall, England |
| Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H11NO3S |
| InChI | InChI=1S/C14H11NO3S/c16-9-12-6-7-14(13(8-12)15(17)18)19-10-11-4-2-1-3-5-11/h1-9H,10H2 |
| InChIKey | UIXPQYSMFXQEMB-UHFFFAOYSA-N |
| Instrument Name | BRUKER AC-300 |
| Melting Point | 166-168C |
| Molecular Weight | 273.31 |
| Solvent | DMSO-d6; Reference=TMS; Temperature 297K |