| SpectraBase Compound ID | ICGuV43nZnp |
|---|---|
| InChI | InChI=1S/C9H8OS/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4H,5-6H2 |
| InChIKey | CVQSWZMJOGOPAV-UHFFFAOYSA-N |
| Mol Weight | 164.22 g/mol |
| Molecular Formula | C9H8OS |
| Exact Mass | 164.029586 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LEjJWSbar4S |
|---|---|
| Name | THIOCHROMAN-4-ONE |
| Source of Sample | Eastman Organic Chemicals, Rochester, New York |
| Boiling Point | 154C/12mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H8OS |
| InChI | InChI=1S/C9H8OS/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-4H,5-6H2 |
| InChIKey | CVQSWZMJOGOPAV-UHFFFAOYSA-N |
| Melting Point | 27-29C |
| Molecular Weight | 164.23 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |