| SpectraBase Compound ID | 9jITZM8HycG |
|---|---|
| InChI | InChI=1S/C8H7NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2 |
| InChIKey | MDKCFLQDBWCQCV-UHFFFAOYSA-N |
| Mol Weight | 149.21 g/mol |
| Molecular Formula | C8H7NS |
| Exact Mass | 149.02992 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EjrhlY33Pr6 |
|---|---|
| Name | ISOTHIOCYANIC ACID, BENZYL ESTER |
| Source of Sample | Eastman Organic Chemicals, Rochester, New York |
| Boiling Point | 114-116C/5mm |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H7NS |
| InChI | InChI=1S/C8H7NS/c10-7-9-6-8-4-2-1-3-5-8/h1-5H,6H2 |
| InChIKey | MDKCFLQDBWCQCV-UHFFFAOYSA-N |
| Molecular Weight | 149.22 |
| Solvent | Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20 |