| SpectraBase Compound ID | COK4Vt4rfED |
|---|---|
| InChI | InChI=1S/C13H9NO3S/c15-9-10-6-7-13(12(8-10)14(16)17)18-11-4-2-1-3-5-11/h1-9H |
| InChIKey | ATBVFIKZUSBTDE-UHFFFAOYSA-N |
| Mol Weight | 259.28 g/mol |
| Molecular Formula | C13H9NO3S |
| Exact Mass | 259.030314 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 6QZn7HRISTb |
|---|---|
| Name | 3-NITRO-4-(PHENYLTHIO)BENZALDEHYDE |
| Source of Sample | Bionet Research Ltd., Cornwall, England |
| Copyright | Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H9NO3S |
| InChI | InChI=1S/C13H9NO3S/c15-9-10-6-7-13(12(8-10)14(16)17)18-11-4-2-1-3-5-11/h1-9H |
| InChIKey | ATBVFIKZUSBTDE-UHFFFAOYSA-N |
| Instrument Name | BRUKER AC-300 |
| Melting Point | 88-90C |
| Molecular Weight | 259.29 |
| Solvent | DMSO-d6; Reference=TMS; Temperature 297K |